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559

抑制剂 & 化合物

70

天然产物

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Cat. No.	Product Name	Target	Signaling Pathways
T13145	Thiazolidinone-Derivatives-1	Others	Others
	Thiazolidinone-Derivatives-1 抑制胃酸分泌，可用于研究胃和十二指肠溃疡的治疗。
T67717L	Questiomycin A derivatives 18 TFA
	Questiomycin A derivatives 18 TFA 是一种Questiomycin A 衍生物，Questiomycin A 具有抗菌和抗癌活性，对细胞保护性 ER 伴侣蛋白 GRP78 的表达具有抑制作用。
T77738L	Questiomycin A derivatives 35 HCl Phx-3 derivatives 35 HCl	Others	Others
	无
T19226	Calcitriol Derivatives	Others	Others
	Calcitriol Derivatives is an analog of vitamin D3.
T67713	Questiomycin A derivatives 14	Others	Others
	Questiomycin A derivatives 14 是一种 Questiomycin A 衍生物。
T67711	Questiomycin A derivatives 12	Others	Others
	Questiomycin A derivatives 12 是一种Questiomycin A 衍生物。
T67712	Questiomycin A derivatives 13	Others	Others
	Questiomycin A derivatives 13 是一种 Questiomycin A 衍生物。
T67719	Questiomycin A derivatives 20	Others	Others
	Questiomycin A derivatives 20 是一种Questiomycin A 衍生物。
T67720	Questiomycin A derivatives 21
	Questiomycin A derivatives 21 是一种有用的有机化合物，可用于生命科学领域的相关研究。其产品编号为 T67720，CAS号为 1807725-36-5。
T67723	Questiomycin A derivatives 24
	Questiomycin A derivatives 24 是一种有用的有机化合物，可用于生命科学领域的相关研究。其产品编号为 T67723，CAS号为 21033-44-3。
T67725	Questiomycin A derivatives 26

T72086	Questiomycin A derivatives 27
	Questiomycin A derivatives 27 是一种有用的有机化合物，可用于生命科学领域的相关研究，其产品编号为 T72086。
T67721	Questiomycin A derivatives 22
	Questiomycin A derivatives 22 是一种有用的有机化合物，可用于生命科学领域的相关研究。其产品编号为 T67721，CAS号为 1807725-35-4。
T8866	GW779439X	Apoptosis; Antibacterial; CDK; Aurora Kinase	Apoptosis; Cell Cycle/Checkpoint; Chromatin/Epigenetic; Microbiology/Virology
	GW779439X 属于吡唑并吡啶类，是一种金黄色葡萄球菌 PASTA 激酶 Stk1抑制剂。它是一种AURKA 抑制剂，可通过 caspases 3/7 诱导细胞凋亡。
T9945	MNK8 3-methyl-6-(naphthalen-1-yl)pyrimidine-2,4(1H,3H)-dione	STAT	JAK/STAT signaling; Stem Cells
	MNK8 (3-methyl-6-(naphthalen-1-yl)pyrimidine-2,4(1H,3H)-dione) 是一种有效的STAT3抑制剂，降低STAT3与DNA 结合的能力，对肝癌细胞也有良好的生长抑制作用。
T4296	MTX-211 MTX 211	EGFR; PI3K	Angiogenesis; JAK/STAT signaling; PI3K/Akt/mTOR signaling; Tyrosine Kinase/Adaptors
	MTX-211 是EGFR 和PI3K 的双重抑制剂，可用于癌症和其他疾病研究。
T2192	Indazole	Sodium Channel	Membrane transporter/Ion channel
	Indazole 又称benzpyrazole 或isoindazone，它的衍生物表现出广泛的生物活性，吲哚唑及其衍生物可用于癌症、神经系统疾病、心血管疾病、胃肠道疾病的研究
T33676	Niraxostat Y 700,Y700,Y-700	Xanthine Oxidase	Metabolism
	Niraxostat (Y-700) 是作为黄嘌呤氧化酶抑制剂的异胞嘧啶衍生物之一。
T9968	3-Piperidinyl(1-pyrrolidinyl)methanone hydrochloride	Others	Others
	3-Piperidinyl(1-pyrrolidinyl)methanone hydrochloride 可用于合成 MCH-R1 拮抗剂 piperidin-4-yl-urea 衍生物。
T5388	2,5-PYRIDINEDICARBOXYLIC ACID	Others	Others
	2,5-PYRIDINEDICARBOXYLIC ACID 用于制备新的衍生物作为抗病毒剂。
T12612	(R)-Apremilast R-阿普斯特,(R)-CC-10004	Others	Others
	(R)-Apremilast ((R)-CC-10004) 是一种 Apremilast 的异构体。
TP1711	5-Tamra-DRVYIHP	Others	Others
	5-Tamra-DRVYIHP 是一种含有用寡核苷酸标记的罗丹明衍生物的多肽。
T38311	(S)-3-Thienylglycine	Others	Others
	(S)-3-Thienylglycine 是一种噻吩衍生物，可用于研究与噻吩衍生物相似结构的遗传毒性。
T1106	Afalanine N-Acetyl-DL-phenylalanine,阿丙氨酸	Amino Acids and Derivatives	Metabolism
	Afalanine (N-Acetyl-DL-phenylalanine) 是抗抑郁药。
T67568	Fmoc-Met-OH Fmoc-L-Met-OH
	Fmoc-Met-OH (Fmoc-L-Met-OH) 是一种基于fmoc的程序合成的甲硫氨酸衍生物。
T9632	CDK9-IN-30	HIV Protease	Microbiology/Virology; Proteases/Proteasome
	CDK9-IN-30 是 Tat 肽衍生物之一，可抑制 HIV-1 长末端重复激活转录。
T20324	Butyrophenone 苯丁酮,NSC8463,NSC 8463,NSC-8463	Others	Others
	Butyrophenone (NSC-8463) 是一种化合物。它的一些衍生物用于治疗各种精神疾病。
T0538	3-Methylindolin-2-one 3-Methyloxindole,3-Methyl-2-oxindole,3-甲基羟基吲哚	Others; Endogenous Metabolite	Metabolism; Others
	3-Methylindolin-2-one (3-Methyloxindole) 是内源性代谢产物的一种。
T9624	iron chloride hexahydrate
	iron chloride hexahydrate 促进了苯基酮衍生物的选择性羟基化和氯化反应，用于构建杂四元骨架。
T79830	B-Raf IN 16	Raf	MAPK
	B-Raf IN 16，一种 BRAF 抑制剂，属于环状亚氨基嘧啶衍生物，可用于研究癌症或肿瘤。
T9823	WAY-325398	Others	Others
	WAY-325398是一种呋喃衍生物。WAY-325398抑制破骨细胞形成，10μM 时抑制率为14.11%。
T1731	TAME hydrochloride NA-P-甲苯磺酰-L-精氨酸甲酯盐酸盐,Tos-Arg-OMe HCl,TOS-ARG-OME hydrochloride	Amino Acids and Derivatives; APC	Cell Cycle/Checkpoint; Metabolism
	TAME hydrochloride (Tos-Arg-OMe HCl) 是后期促进复合体(APC/C 或 APC)的抑制剂，可与 APC/C 结合并阻止其通过 Cdc20 和 Cdh1 活化，产生有丝分裂阻滞。它是一种 od 氨基酸衍生物。
T21412	Ketorolac Toradol,Sprix,Acuvail,Macril,酮咯酸,Acular	COX	Immunology/Inflammation; Neuroscience
	Ketorolac (Acuvail) 是非甾体抗炎剂，是非选择性的COX 抑制剂，对 COX-1 和 COX-2 的IC50值分别为 20 和 120 nM。
T9526	Polysorbate 20 Tween-20,吐温 20	Others	Others
	Polysorbate 20 (Tween-20) 是聚氧乙烯型非离子表面活性剂。
T68127	Picenadol LY-150720,LY150720,LY 150720	Others	Others
	Picenadol (LY 150720) 是N-甲基-4-苯基哌啶衍生物的外消旋混合物，具有激动剂 - 拮抗剂阿片性质。Picenadol 具有中枢镇痛活性。
T38345	SQ609
	SQ609是从一个双哌啶衍生物库中选取的抗结核潜在药物。SQ609在体外小鼠巨噬细胞中具有显著的抗结核活性。
T18905	6-TAMRA 6-羧基四甲基罗丹明,6-Carboxytetramethylrhodamine	Others	Others
	6-TAMRA (6-Carboxytetramethylrhodamine) 常用作制备生物偶联物的荧光团，尤其是用于免疫化学的荧光抗体剂抗生物素蛋白衍生物。
T67792	BTA-188	Antiviral	Immunology/Inflammation
	BTA-188是一种新型的和具有口服活性的合成的苯并恶唑和苯并噻唑衍生物中有效的类似物，具有显著抗鼻病毒活性。
T20509	Lophine 2,4,5-Triphenylimidazole,2，4，5-三苯基咪唑,NSC 62790,NSC-62790,NSC62790	Others	Others
	Lophine (NSC-62790) 用于合成蛋白激酶抑制剂、钙拮抗剂、强心强心剂和抗肿瘤药物。 Lophine 衍生物作为体外化学发光活化剂用于检测自由基。
T14131	ADPS N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt,ESPAS	Others	Others
	ADPS (N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt) 是新型 Trinder's 试剂，是一种高水溶性苯胺衍生品，普遍用于生化试验、诊断检测。
T21551	2-hexyl-4-Pentynoic Acid	HDAC	Chromatin/Epigenetic; DNA Damage/DNA Repair
	2-Hexyl-4-pentynoic acid 是一种丙戊酸 (VPA) 衍生物，可以抑制HDAC(IC50=13 µM) 和诱导HSP70。它可引起培养神经元的组蛋白高度乙酰化，防止谷氨酸诱导的兴奋性毒性，具有强大的神经保护作用。
T12987	Spirodiclofen BAJ-2740,螺螨酯	Parasite	Microbiology/Virology
	Spirodiclofen (BAJ-2740) 是选择性非系统性的杀螨剂，来自新的化学类特酮酸衍生物，与目前市面上的杀螨剂无交叉耐药, 具有额外的杀虫性能。
T4469	Nemorubicin Methoxymorpholinyldoxorubicin,PNU-152243A,PNU 152243,奈莫柔比星	Others	Others
	Nemorubicin (PNU 152243) 是一种 Doxorubicin 衍生物，具有抗肿瘤活性。它需要完整的核苷酸切除修复系统才能发挥活性。它对多药耐药表型的多种肿瘤细胞系具有细胞毒性。
T77674	3-Cyano-7-hydroxycoumarin 3-Cyanoumbelliferone
	3-Cyano-7-hydroxycoumarin (3-Cyanoumbelliferone) 是一种巨噬细胞游走抑制因子 (MIF) 互变异构酶抑制剂，Ki 为 2.9 μM。3-Cyano-7-hydroxycoumarin 属于香豆素衍生物，可被用作分子探针和荧光染料。
TNU0168	2'-Deoxy-2'-fluoro-beta-D-arabinoguanosine	Apoptosis	Apoptosis
	Nucleoside Derivatives - Fluoro-modified nucleosides, Arabino-nucleosides, 2’-Modified nucleosides; Drugs and Inhibitors; Anticancer agent; Impurity C of Clofarabine
T31011	Coralyne chloride	Topoisomerase	DNA Damage/DNA Repair
	Coralyne chloride 是一种具有强抗癌活性的原小檗碱。它可用于制备 Coralyne 衍生物，是一种基于荧光 DNA 的分子整流剂，通过位点特异性插入构建成 DNA 双链体。它可作为一种拓扑异构酶 I 毒性分子，诱导拓扑异构酶 I 介导 DNA 裂解。
T8749	CS-B1628 2-(6-溴-5-甲基-2,4-二氧代-1,4-二氢噻吩并[2,3-D]嘧啶-3(2H) - 基)-,tert-Butyl 2-(6-bromo-5-methyl-2,4-dioxo-1,4-dihydrothieno[2,3-d]pyrimidin-3(2H)-yl)-2-methylpropanoate,ACN-053859	Others	Others
	CS-B1628 (tert-Butyl 2-(6-bromo-5-methyl-2,4-dioxo-1,4-dihydrothieno[2,3-d]pyrimidin-3(2H)-yl)-2-methylpropanoate) 可用于合成嘧啶衍生物，具有成为各种有机化合物（包括药物和农用化学品）起始材料的潜在用途。
TD0101	AQC 6-Aminoquinolyl-N-hydroxysccinimidyl carbamate	Others	Others
	AQC (6-Aminoquinolyl-N-hydroxysccinimidyl carbamate) 是一种高效液相色谱荧光检测氨基酸或蛋白质序列的试剂。它能够与一级和二级氨基酸反应生成荧光衍生物，在皮摩尔水平下能够检测氨基酸。
T0056	Oxeladin citrate	Others	Others
	Oxeladin citrate 是止咳剂，能够对各种病因引发咳嗽进行有效研究。
T11043	Dihydroergocristine mesylate 甲磺酸双氢麦角汀,DHEC (mesylate)	Beta Amyloid	Neuroscience
	Dihydroergocristine mesylate (DHEC (mesylate)) 是一种 γ-secretase (GSI) 的抑制剂，能够阿尔茨海默氏病淀粉样蛋白 β 肽 (amyloid-β) 的产生，与 γ-secretase 和 Nicastrin 结合的平衡解离常数 (Kd) 值分别为 25.7 nM 和 9.8 μM。

化合物

Thiazolidinone-Derivatives-1

Cat.No: T13145

Target: Others

Questiomycin A derivatives 18 TFA

Cat.No: T67717L

Questiomycin A derivatives 35 HCl

Cat.No: T77738L

Synonym: Phx-3 derivatives 35 HCl

Target: Others

Calcitriol Derivatives

Cat.No: T19226

Target: Others

Questiomycin A derivatives 14

Cat.No: T67713

Target: Others

Questiomycin A derivatives 12

Cat.No: T67711

Target: Others

Questiomycin A derivatives 13

Cat.No: T67712

Target: Others

Questiomycin A derivatives 20

Cat.No: T67719

Target: Others

Questiomycin A derivatives 21

Cat.No: T67720

Questiomycin A derivatives 24

Cat.No: T67723

Questiomycin A derivatives 26

Cat.No: T67725

Questiomycin A derivatives 27

Cat.No: T72086

Questiomycin A derivatives 22

Cat.No: T67721

Cat.No: T8866

Target: Apoptosis, Antibacterial, CDK, Aurora Kinase

Cat.No: T9945

Synonym: 3-methyl-6-(naphthalen-1-yl)pyrimidine-2,4(1H,3H)-dione

Target: STAT

Cat.No: T4296

Synonym: MTX 211

Target: EGFR, PI3K

Cat.No: T2192

Target: Sodium Channel

Cat.No: T33676

Synonym: Y 700,Y700,Y-700

Target: Xanthine Oxidase

3-Piperidinyl(1-pyrrolidinyl)methanone hydrochloride

Cat.No: T9968

Target: Others

2,5-PYRIDINEDICARBOXYLIC ACID

Cat.No: T5388

Target: Others

Cat.No: T12612

Synonym: R-阿普斯特,(R)-CC-10004

Target: Others

5-Tamra-DRVYIHP

Cat.No: TP1711

Target: Others

(S)-3-Thienylglycine

Cat.No: T38311

Target: Others

Cat.No: T1106

Synonym: N-Acetyl-DL-phenylalanine,阿丙氨酸

Target: Amino Acids and Derivatives

Cat.No: T67568

Synonym: Fmoc-L-Met-OH

Cat.No: T9632

Target: HIV Protease

Cat.No: T20324

Synonym: 苯丁酮,NSC8463,NSC 8463,NSC-8463

Target: Others

3-Methylindolin-2-one

Cat.No: T0538

Synonym: 3-Methyloxindole,3-Methyl-2-oxindole,3-甲基羟基吲哚

Target: Others, Endogenous Metabolite

iron chloride hexahydrate

Cat.No: T9624

Cat.No: T79830

Target: Raf

Cat.No: T9823

Target: Others

TAME hydrochloride

Cat.No: T1731

Synonym: NA-P-甲苯磺酰-L-精氨酸甲酯盐酸盐,Tos-Arg-OMe HCl,TOS-ARG-OME hydrochloride

Target: Amino Acids and Derivatives, APC

Cat.No: T21412

Synonym: Toradol,Sprix,Acuvail,Macril,酮咯酸,Acular

Target: COX

Cat.No: T9526

Synonym: Tween-20,吐温 20

Target: Others

Cat.No: T68127

Synonym: LY-150720,LY150720,LY 150720

Target: Others

Cat.No: T38345

Cat.No: T18905

Synonym: 6-羧基四甲基罗丹明,6-Carboxytetramethylrhodamine

Target: Others

Cat.No: T67792

Target: Antiviral

Cat.No: T20509

Synonym: 2,4,5-Triphenylimidazole,2，4，5-三苯基咪唑,NSC 62790,NSC-62790,NSC62790

Target: Others

Cat.No: T14131

Synonym: N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt,ESPAS

Target: Others

2-hexyl-4-Pentynoic Acid

Cat.No: T21551

Target: HDAC

Cat.No: T12987

Synonym: BAJ-2740,螺螨酯

Target: Parasite

Cat.No: T4469

Synonym: Methoxymorpholinyldoxorubicin,PNU-152243A,PNU 152243,奈莫柔比星

Target: Others

3-Cyano-7-hydroxycoumarin

Cat.No: T77674

Synonym: 3-Cyanoumbelliferone

2'-Deoxy-2'-fluoro-beta-D-arabinoguanosine

Cat.No: TNU0168

Target: Apoptosis

Coralyne chloride

Cat.No: T31011

Target: Topoisomerase

Cat.No: T8749

Synonym: 2-(6-溴-5-甲基-2,4-二氧代-1,4-二氢噻吩并[2,3-D]嘧啶-3(2H) - 基)-,tert-Butyl 2-(6-bromo-5-methyl-2,4-dioxo-1,4-dihydrothieno[2,3-d]pyrimidin-3(2H)-yl)-2-methylpropanoate,ACN-053859

Target: Others

Cat.No: TD0101

Synonym: 6-Aminoquinolyl-N-hydroxysccinimidyl carbamate

Target: Others

Oxeladin citrate

Cat.No: T0056

Target: Others

Dihydroergocristine mesylate

Cat.No: T11043

Synonym: 甲磺酸双氢麦角汀,DHEC (mesylate)

Target: Beta Amyloid

Cat. No.	Product Name	Target	Signaling Pathways
T20003	Acridone	Antibacterial; ABC	Membrane transporter/Ion channel; Microbiology/Virology
	Acridone 具有抗菌、抗疟、抗病毒和抗肿瘤活性。它可诱导细胞凋亡，抑制 ABCG2 蛋白，并调节激素水平。
TN7020	Astragenol	Others	Others
	Astragenol 是合成黄芪醇衍生物的中间体。它的衍生物具有抗炎作用，可用于前列腺癌的研究。
T1346	1-Phenyl-1,2-ethanediol	Others	Others
	1-Phenyl-1,2-ethanediol 是 O-benzyl oxime ether 衍生物，用作杀虫剂。
T4795	Pimelic acid Pileric acid,1,7-Heptanedioic acid,庚二酸,1,5-Pentanedicarboxylic acid	Others; Endogenous Metabolite	Metabolism; Others
	Pimelic acid (1,5-Pentanedicarboxylic acid) 的衍生物能够参与赖氨酸的生物合成。
TL0015	Pyromeconic acid 3-羟基-4氢-吡喃-4-酮,3-hydroxy-4H-pyran-4-one	Anti-infection	Microbiology/Virology
	Pyromeconic acid (3-hydroxy-4H-pyran-4-one) 及其衍生物是核酸内切酶的有效抑制剂
TN7071	Ergosterol Acetate Ergosta-5,7,22-trien-3-beta-yl acetate	Others	Others
	Ergosterol Acetate (Ergosta-5,7,22-trien-3-beta-yl acetate) 是来自红曲霉的 Ergosterol 的乙酸酯衍生物之一。
T9327	ω-Pentadecalactone Cyclopentadecanolide,ω-十五内酯,Oxacyclohexadecan-2-one,Exaltolide,Pentadecanolide	Others	Others
	ω-Pentadecalactone (Exaltolide) 是香料成分，是一种香味结构组大环内酯和丙交酯衍生物的成员。
T4798	N-Acetyl-L-leucine	Others; Endogenous Metabolite	Metabolism; Others
	N-Acetyl-L-leucine 是内源性代谢产物的一种。
T2832	Isocorydine Artabotrin,S-Isocorydine(+),异紫堇定,Luteanin,Uzokoridin,(+)-Isocorynoline	Others; Endogenous Metabolite	Metabolism; Others
	S-Isocorydine (Uzokoridin)(+) 是一种从美德罗克线虫 Dicranostigma leptopodum (Maxim.) Fedde 中分离得到，与阿霉素的结合具有消除肝细胞癌的潜力。
T4712	H-D-cis-Hyp-OH 顺式-4-羟基-D-脯氨酸,D-allo-Hydroxyproline,cis-4-Hydroxy-D-proline	Others; Endogenous Metabolite	Metabolism; Others
	H-D-cis-Hyp-OH (D-allo-Hydroxyproline) 是一种合成构象受限的 PNA 腺嘌呤单体的前体，能够用于 D-丙氨酸脱氢酶的特异性和动力学的研究。
TJS0338	4-Methylesculetin 4-Methyl-6,7-dihydroxycoumarin,6,7-二羟基-4-甲基香豆素,Methylesculetin,4-甲基七叶亭	Antioxidant; Glutathione Peroxidase	Metabolism; oxidation-reduction
	4-Methylesculetin (Methylesculetin) 是口服具有活力的天然香豆素衍生物，有抗氧化、抗炎特性。它可抑制myeloperoxidase 的特性，抑制 IL-6 的水平
T4711	2,4-Dihydroxypyrimidine-5-carboxylic acid 脲嘧啶-5-羧酸,Isoorotic acid,Uracil-5-carboxylic acid	Others; Endogenous Metabolite	Metabolism; Others
	2,4-Dihydroxypyrimidine-5-carboxylic acid (Isoorotic acid) 是内源性代谢产物的一种。
TNU0157	3’-O-Methyl guanosine	Endogenous Metabolite	Metabolism
	核苷衍生物 – 3’-改性核苷：该化合物属于核苷衍生物类，特点是在其3’位置上进行了化学修饰。这种修饰赋予了化合物特殊的生物学活性或增强了其原有功能，常见于药物研发及生物医学研究中。
T10388	Asparagusic acid 1,2-二噻戊环-4-羧酸,芦笋酸	Parasite	Microbiology/Virology
	Asparagusic acid 是芦笋植物中的一种含硫气味成分，是植物生长抑制剂，具有抗寄生虫作用。
TJS0405	Lucidin NSC 30546,芦西定；卢西定,卢西定,亮黄素,Henine	Others	Others
	Lucidin (NSC-30546) 是茜草中的一种天然成分，可以诱导细菌和哺乳动物细胞的突变。
T2734	Sennoside B 番泻苷 B,番泻苷B	PDGFR	Angiogenesis; Tyrosine Kinase/Adaptors
	Sennoside B 是在番泻叶的叶子和豆荚中大量发现的蒽醌苷。它可通过与 PDGF-BB 及其受体结合并下调 PDGFR-β 信号传导途径来抑制 PDGF 刺激的细胞增殖。
T4842	1H-pyrazole 1,2-Diazole,Pyrazole,吡唑	Others; Endogenous Metabolite	Metabolism; Others
	1H-pyrazole (1,2-Diazole) 是内源性代谢产物的一种。
TN1097	β-Boswellic acid Beta-boswellic acid,β-乳香酸	Lipoxygenase; DNA/RNA Synthesis	Cell Cycle/Checkpoint; DNA Damage/DNA Repair; Metabolism
	β-Boswellic acid (Beta-boswellic acid) 是从乳香的树胶脂中分离出来的一种天然产物。它是 5-脂氧合酶(5-LO) 产物形成的非还原型抑制剂，其直接与 5-LO 相互作用或阻断其易位。具有抗癌、抗肿瘤和抗高血脂活性。
T2981	Xanthoxylin Brevifolin,Xanthoxyline,花椒素,2'-Hydroxy-4',6'-dimethoxyacetophenone	Others; Antifungal	Microbiology/Virology; Others
	Xanthoxylin (Brevifolin)e 是从Zanthoxylum simulans 中分离出来的是一种冰片和樟脑味化合物，有抗真菌和抗癫痫作用。
Fr16741	Oxindole 2-吲哚酮,板蓝根,Indolin-2-one	Others; HIV Protease	Microbiology/Virology; Others; Proteases/Proteasome
	Oxindole (Indolin-2-one) 是一种芳族杂环砌块，其衍生物是激酶抑制剂研究中的主要成分。
T1301	Guaiacol O-methylcatechol,2-hydroxyanisole,o-methoxyphenol,2-Methoxyphenol,愈创木酚	NF-κB; COX; Endogenous Metabolite	Immunology/Inflammation; Metabolism; Neuroscience; NF-κB
	Guaiacol (2-Methoxyphenol) 是从小叶栲中提取的一种酚类，可抑制 LPS 刺激的COX-2表达和NF-κB 激活，具有抗炎活性。
T8274	3-Methyl-L-histidine	Endogenous Metabolite	Metabolism
	3-Methyl-L-histidine 是一种肉类尤其是鸡肉摄入和大豆制品摄入的生物标记。
T5S2017	Ingenol (-)-Ingenol,巨大戟二萜醇,巨大戟醇	PKC	Chromatin/Epigenetic; Cytoskeletal Signaling
	Ingenol ((-)-Ingenol) 是一种PKC 激活剂，Ki 值为 30 μM，具有抗肿瘤活性。从 Ingenol 酯中配制新的衍生物可能是开发新的先导化合物以重新激活潜伏 HIV 的创新方法。Ingenol mebutate 是治疗光化性角化病的有效方法。
T4773	3-Ethoxy-3-oxopropanoic acid Monoethyl malonic acid,Ethyl hydrogen malonate,丙二酸单乙酯	Others; Endogenous Metabolite	Metabolism; Others
	3-Ethoxy-3-oxopropanoic acid (Monoethyl malonic acid) 是内源性代谢产物的一种。
TCS1772	Dehydroabietic acid Dehydroabietate,脱氢松香酸	Antifection	Microbiology/Virology
	Dehydroabietic acid (Dehydroabietate) 是 EBV-EA 活化抑制剂。它是食物衍生化合物，可通过降低血浆葡萄糖、胰岛素水平、血浆甘油三酯 (TG) 和肝 TG 水平来治疗肥胖相关疾病。它的衍生物在动物模型中表现出抗分泌和抗胃蛋白酶作用。
TCS1372	Atraric acid	Phosphatase; Androgen Receptor	Endocrinology/Hormones; Metabolism
	Atraric acid 衍生物作为一种新的化学先导结构，用于作为 AR 拮抗剂的新型治疗化合物，可用于预防或治疗前列腺疾病。它以剂量依赖性方式抑制 PTP1B 活性，IC50 值为 51.5 uM，表明阿特拉酸具有治疗糖尿病的潜力。
T4768	Diethyl oxalpropionate 草酰丙酸二乙酯,HYL 2-METHYL-3-OXOSUCCINATE	Others; Endogenous Metabolite	Metabolism; Others
	Diethyl oxalpropionate (HYL 2-METHYL-3-OXOSUCCINATE) 是一种合成 PDMMLA 的中间体。其中 PDMMLA 的衍生物可用于纳米粒子的合成和研究。
TL0005	3,5-O-Dicaffeoylquinic acid Isochlorogenic Acid A,(-)-3,5-二咖啡酰奎宁酸,(-)-3,5-Dicaffeoyl quinic acid,3,5-Dicaffeoylquinic Acid	Others	Others
	3,5-O-Dicaffeoylquinic acid (Isochlorogenic Acid A) 能够改善由三甲基锡诱导的学习和记忆缺陷。
TN6909	Polyporusterone B 猪苓酮B,(1R,2R,4S,5R,7R,11R,14S,15R)-14-[(2R,3R)-2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-4,5,11-trihydroxy-2,15-dimethyltetracyclo[8.7.0.02,?.011,1?]heptadec-9-en-8-one	Others	Others
	Polyporusterone B ((1R,2R,4S,5R,7R,11R,14S,15R)-14-[(2R,3R)-2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-4,5,11-trihydroxy-2,15-dimethyltetracyclo[8.7.0.02,?.011,1?]heptadec-9-en-8-one) 是一种三萜羧酸，从Polyporus umbellatusFries 中分离得到。它对自由基诱导的红细胞裂解 (溶血) 具有抑制作用。
T1183	Retinol all-trans-Retinol,视黄醇,Vitamin A,Vitamin A1,Alphalin	Others	Others
	Retinol (Alphalin) 及其衍生物，在视网膜的代谢功能、上皮组织的生长和分化、骨骼的生长、生殖和免疫反应中起重要作用。膳食维生素 A 来源于植物中发现的多种类胡萝卜素。它富含肝脏、蛋黄和乳制品的脂肪成分。
T2P2923	Stearic acid 硬脂酸,Isostearic acid,Octadecanoic acid,Cetylacetic acid	Phosphatase; Endogenous Metabolite	Metabolism
	Stearic acid (Cetylacetic acid) 是长链饱和脂肪酸，存在于许多动植物油脂中。
T1121	Podofilox 鬼臼毒素,Podophyllotoxin,(+)-Shikonin	Microtubule Associated; Topoisomerase	Cytoskeletal Signaling; DNA Damage/DNA Repair
	Podofilox ((+)-Shikonin) 是从八角莲中分离的一种木脂素，是微管组装和 DNA 拓扑异构酶 II 抑制剂。它对皮肤和粘膜有很强的刺激性，具有角质溶解作用，可用于治疗疣和角化病，具有潜在的抗肿瘤特性。
T5S0018	Betulonic acid 路路通酸,(+)-Betulonic acid,Betunolic acid,Liquidambaric acid	Parasite; HSV	Microbiology/Virology
	Betulonic acid (Liquidambaric acid) 是一种在许多植物中存在的三萜类天然产物，具有抗肿瘤，抗炎，抗寄生虫和抗病毒的活性。
TJO2758	D-Glucuronic acid D-葡萄糖醛酸,Aldehydo-D-Glucuronic Acid	Others; Endogenous Metabolite	Metabolism; Others
	D-Glucuronic acid (Aldehydo-D-Glucuronic Acid) 是一种从许多树胶中分离出的重要中间体。它对皮肤具有抗炎作用。它及其衍生物葡萄糖醛酸内酯作为预防人类健康的肝脏解毒剂。
T4900	(±)-Methyl Jasmonate (±)-茉莉酸甲酯,甲基茉莉酮酸酯,(±)-Jasmonic Acid methyl ester,Methyl 2-(3-oxo-2-(pent-2-en-1-yl)cyclopentyl)acetate	Others; Endogenous Metabolite	Metabolism; Others
	Methyl 2-(3-oxo-2-(pent-2-en-1-yl)cyclopentyl)acetate ((±)-Jasmonic Acid methyl ester) 是内源性代谢产物的一种。
T4848	Mandelic acid acidomandelico,DL-Mandelic acid,扁桃酸	Others; Endogenous Metabolite; Antibacterial	Metabolism; Microbiology/Virology; Others
	DL-Mandelic acid (acidomandelico) 是一种 α-羟基羧酸，有抗菌活性，广泛用作医药和精细化学品的中间体，已用于研究尿路感染和阴道滴虫病，还具有较高的精子固定活性和较低的阴道刺激性。
T3339	Sophoridine 5-Epidihydrosophocarpine,槐定碱,Dihydro-5-episophocarpine	Apoptosis; Topoisomerase	Apoptosis; DNA Damage/DNA Repair
	Sophoridine (Dihydro-5-episophocarpine) 是一种从豆科植物槐豆斜生植物的叶子中分离出来的喹喔啉生物碱。它是胰腺癌的候选药物，诱导细胞凋亡。
T3929	Kaurenoic acid Kauren-19-Oic Acid,异贝壳杉烯酸,kaurenoate,kaur-16-en-18-oic acid	Others	Others
	Kaurenoic acid (kaurenoate) 是一种二萜，来源于 Sphagneticola trilobata 中，可以抑制细胞因子的产生和激活 NO–cyclic GMP–PKG–ATP- 敏感型钾通道信号通路，并抑制炎症疼痛。
T4880	L-Dihydroorotic acid	Others; Endogenous Metabolite	Metabolism; Others
	L-Dihydroorotic acid 是一种能够通过二氢乳清酶，能够逆水解产生的无环 L-脲基琥珀酸。
T36914	2-Hydroxyanthraquinone	Others	Others
	2-Hydroxyanthraquinone 是一种天然产物，显示出抗肿瘤和免疫抑制活性。
T4858	4-Hydroxyphenylpyruvic acid 4-羟苯基丙酮酸,4-Hydroxyphenylpyruvic acid	Endogenous Metabolite	Metabolism
	4-Hydroxyphenylpyruvic acid 是一种苯丙氨酸代谢的中间产物，是一种酶抑制剂。
T5S2343	Acetylshikonin 乙酰紫草素,Acetyl shikonin	Others; P450; AChE	Metabolism; Neuroscience; Others
	Acetylshikonin 来源于紫草根，具有抗癌、抗炎作用。它是一种 AChE 抑制剂，具有很强的抗凋亡活性。它是一种非选择性的细胞色素 P450抑制剂，对所有 P450 亚型抑制的 IC50值范围为 1.4-4.0 μM。
T4707	3-Hydroxyanthranilic acid 3-HYDROXY-2-AMINOBENZOIC ACID,3-羟基-2-氨基苯甲酸	Others; Endogenous Metabolite	Metabolism; Others
	3-Hydroxyanthranilic acid (3-HYDROXY-2-AMINOBENZOIC ACID) 是犬尿氨酸途径中的色氨酸代谢物。它已在人类表皮和膀胱组织中发现，并且在多种生物体液中也已检测到，例如尿液和血液。在细胞内，它主要位于细胞质中。它存在于从酵母到人类的所有真核生物中。
TN2028	p-Coumaryl alcohol	Others	Others
	p-Coumaryl alcohol derivatives have antioxidant activity.
T3S2016	Epoxylathyrol	Others	Others
	Epoxylathyrol derivatives have modulation of ABCB1-mediated multidrug resistance in human colon adenocarcinoma and mouse T-Lymphoma cells.
T19515	Phosphocreatine dipotassium Creatinephosphoric acid (dipotassium),Creatine phosphate (dipotassium)	Others	Others
	Phosphocreatine dipotassium, primarily found in the skeletal muscles of vertebrates and one of organic compounds known as alpha amino acids and derivatives.
TN6511	Tessaric acid
	Tessaric acid has antifeedant and allelochemical effects. Tessaric acid derivatives induce G/M cell cycle arrest in human solid tumor cell lines.
TN3042	4-Hydroxycinnamamide	ATPase; EGFR; Potassium Channel; p38 MAPK; Calcium Channel; Sodium Channel; AMPK	Angiogenesis; Chromatin/Epigenetic; JAK/STAT signaling; MAPK; Membrane transporter/Ion channel; Metabolism; PI3K/Akt/mTOR signaling; Tyrosine Kinase/Adaptors
	4-Hydroxycinnamamide has antioxidant activity. 4-Hydroxycinnamamide derivatives are specific inhibitors of tyrosine-specific protein kinases.
TN1477	Ceanothic acid	Others	Others
	Ceanothic acid derivatives show cytotoxic effect against OVCAR-3 and HeLa cancer cell lines.
TN1570	Deoxyvasicinone 脱氧鸭嘴花酮碱	Others	Others
	Deoxyvasicinone derivatives can be considered as promising lead molecules for the development of more potent inhibitors of NEDD8-activating enzyme.
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天然产物

Cat.No: T20003

Target: Antibacterial, ABC

Cat.No: TN7020

Target: Others

1-Phenyl-1,2-ethanediol

Cat.No: T1346

Target: Others

Cat.No: T4795

Synonym: Pileric acid,1,7-Heptanedioic acid,庚二酸,1,5-Pentanedicarboxylic acid

Target: Others, Endogenous Metabolite

Pyromeconic acid

Cat.No: TL0015

Synonym: 3-羟基-4氢-吡喃-4-酮,3-hydroxy-4H-pyran-4-one

Target: Anti-infection

Ergosterol Acetate

Cat.No: TN7071

Synonym: Ergosta-5,7,22-trien-3-beta-yl acetate

Target: Others

ω-Pentadecalactone

Cat.No: T9327

Synonym: Cyclopentadecanolide,ω-十五内酯,Oxacyclohexadecan-2-one,Exaltolide,Pentadecanolide

Target: Others

N-Acetyl-L-leucine

Cat.No: T4798

Target: Others, Endogenous Metabolite

Cat.No: T2832

Synonym: Artabotrin,S-Isocorydine(+),异紫堇定,Luteanin,Uzokoridin,(+)-Isocorynoline

Target: Others, Endogenous Metabolite

Cat.No: T4712

Synonym: 顺式-4-羟基-D-脯氨酸,D-allo-Hydroxyproline,cis-4-Hydroxy-D-proline

Target: Others, Endogenous Metabolite

4-Methylesculetin

Cat.No: TJS0338

Synonym: 4-Methyl-6,7-dihydroxycoumarin,6,7-二羟基-4-甲基香豆素,Methylesculetin,4-甲基七叶亭

Target: Antioxidant, Glutathione Peroxidase

2,4-Dihydroxypyrimidine-5-carboxylic acid

Cat.No: T4711

Synonym: 脲嘧啶-5-羧酸,Isoorotic acid,Uracil-5-carboxylic acid

Target: Others, Endogenous Metabolite

3’-O-Methyl guanosine

Cat.No: TNU0157

Target: Endogenous Metabolite

Asparagusic acid

Cat.No: T10388

Synonym: 1,2-二噻戊环-4-羧酸,芦笋酸

Target: Parasite

Cat.No: TJS0405

Synonym: NSC 30546,芦西定；卢西定,卢西定,亮黄素,Henine

Target: Others

Cat.No: T2734

Synonym: 番泻苷 B,番泻苷B

Target: PDGFR

Cat.No: T4842

Synonym: 1,2-Diazole,Pyrazole,吡唑

Target: Others, Endogenous Metabolite

β-Boswellic acid

Cat.No: TN1097

Synonym: Beta-boswellic acid,β-乳香酸

Target: Lipoxygenase, DNA/RNA Synthesis

Cat.No: T2981

Synonym: Brevifolin,Xanthoxyline,花椒素,2'-Hydroxy-4',6'-dimethoxyacetophenone

Target: Others, Antifungal

Cat.No: Fr16741

Synonym: 2-吲哚酮,板蓝根,Indolin-2-one

Target: Others, HIV Protease

Cat.No: T1301

Synonym: O-methylcatechol,2-hydroxyanisole,o-methoxyphenol,2-Methoxyphenol,愈创木酚

Target: NF-κB, COX, Endogenous Metabolite

3-Methyl-L-histidine

Cat.No: T8274

Target: Endogenous Metabolite

Cat.No: T5S2017

Synonym: (-)-Ingenol,巨大戟二萜醇,巨大戟醇

Target: PKC

3-Ethoxy-3-oxopropanoic acid

Cat.No: T4773

Synonym: Monoethyl malonic acid,Ethyl hydrogen malonate,丙二酸单乙酯

Target: Others, Endogenous Metabolite

Dehydroabietic acid

Cat.No: TCS1772

Synonym: Dehydroabietate,脱氢松香酸

Target: Antifection

Cat.No: TCS1372

Target: Phosphatase, Androgen Receptor

Diethyl oxalpropionate

Cat.No: T4768

Synonym: 草酰丙酸二乙酯,HYL 2-METHYL-3-OXOSUCCINATE

Target: Others, Endogenous Metabolite

3,5-O-Dicaffeoylquinic acid

Cat.No: TL0005

Synonym: Isochlorogenic Acid A,(-)-3,5-二咖啡酰奎宁酸,(-)-3,5-Dicaffeoyl quinic acid,3,5-Dicaffeoylquinic Acid

Target: Others

Polyporusterone B

Cat.No: TN6909

Synonym: 猪苓酮B,(1R,2R,4S,5R,7R,11R,14S,15R)-14-[(2R,3R)-2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-4,5,11-trihydroxy-2,15-dimethyltetracyclo[8.7.0.02,?.011,1?]heptadec-9-en-8-one

Target: Others

Cat.No: T1183

Synonym: all-trans-Retinol,视黄醇,Vitamin A,Vitamin A1,Alphalin

Target: Others

Cat.No: T2P2923

Synonym: 硬脂酸,Isostearic acid,Octadecanoic acid,Cetylacetic acid

Target: Phosphatase, Endogenous Metabolite

Cat.No: T1121

Synonym: 鬼臼毒素,Podophyllotoxin,(+)-Shikonin

Target: Microtubule Associated, Topoisomerase

Cat.No: T5S0018

Synonym: 路路通酸,(+)-Betulonic acid,Betunolic acid,Liquidambaric acid

Target: Parasite, HSV

D-Glucuronic acid

Cat.No: TJO2758

Synonym: D-葡萄糖醛酸,Aldehydo-D-Glucuronic Acid

Target: Others, Endogenous Metabolite

(±)-Methyl Jasmonate

Cat.No: T4900

Synonym: (±)-茉莉酸甲酯,甲基茉莉酮酸酯,(±)-Jasmonic Acid methyl ester,Methyl 2-(3-oxo-2-(pent-2-en-1-yl)cyclopentyl)acetate

Target: Others, Endogenous Metabolite

Cat.No: T4848

Synonym: acidomandelico,DL-Mandelic acid,扁桃酸

Target: Others, Endogenous Metabolite, Antibacterial

Cat.No: T3339

Synonym: 5-Epidihydrosophocarpine,槐定碱,Dihydro-5-episophocarpine

Target: Apoptosis, Topoisomerase

Cat.No: T3929

Synonym: Kauren-19-Oic Acid,异贝壳杉烯酸,kaurenoate,kaur-16-en-18-oic acid

Target: Others

L-Dihydroorotic acid

Cat.No: T4880

Target: Others, Endogenous Metabolite

2-Hydroxyanthraquinone

Cat.No: T36914

Target: Others

4-Hydroxyphenylpyruvic acid

Cat.No: T4858

Synonym: 4-羟苯基丙酮酸,4-Hydroxyphenylpyruvic acid

Target: Endogenous Metabolite

Cat.No: T5S2343

Synonym: 乙酰紫草素,Acetyl shikonin

Target: Others, P450, AChE

3-Hydroxyanthranilic acid

Cat.No: T4707

Synonym: 3-HYDROXY-2-AMINOBENZOIC ACID,3-羟基-2-氨基苯甲酸

Target: Others, Endogenous Metabolite

p-Coumaryl alcohol

Cat.No: TN2028

Target: Others

Cat.No: T3S2016

Target: Others

Phosphocreatine dipotassium

Cat.No: T19515

Synonym: Creatinephosphoric acid (dipotassium),Creatine phosphate (dipotassium)

Target: Others

Cat.No: TN6511

4-Hydroxycinnamamide

Cat.No: TN3042

Target: ATPase, EGFR, Potassium Channel, p38 MAPK, Calcium Channel, Sodium Channel, AMPK

Cat.No: TN1477

Target: Others

Deoxyvasicinone

Cat.No: TN1570

Synonym: 脱氧鸭嘴花酮碱

Target: Others

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