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28

抑制剂 & 化合物

8

天然产物

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Cat. No.	Product Name	Target	Signaling Pathways
T19780	2,2′-Dipyridyl disulfide 2,2'-Dipyridyl disulfide,OPSS,2,2'-二硫二吡啶,Aldrithiol 2,Orthopyridyl disulfide	Others	Others
	2,2′-Dipyridyl disulfide (Aldrithiol 2) 是肽化学中的常用试剂，是测定巯基的有用试剂，常用于氧化还原缩合以形成肽键或用于偶联反应以形成二硫键连接的异二聚体。
T15212	Emamectin Benzoate MK-244,甲胺基阿维菌素苯甲酸盐	Apoptosis; Reactive Oxygen Species; GABA Receptor; Parasite	Apoptosis; Immunology/Inflammation; Membrane transporter/Ion channel; Metabolism; Microbiology/Virology; Neuroscience; NF-κB
	Emamectin Benzoate (MK-244) 是口服有效的神经系统毒物，其通过结合昆虫中的 GABA 受体发挥作用。它是阿维菌素的半合成衍生物之一，具有广谱的杀虫和杀螨活性。它诱导ROS 介导的 DNA 损伤和细胞凋亡。
T8915	Glycylsarcosine GLYCYL-SARCOSINE,甘氨酰肌氨酸	Others	Others
	Glycylsarcosine (GLYCYL-SARCOSINE) 是由甘氨酸的羧基与肌氨酸的氨基缩合而成的二肽
T21223	Isobutyl decanoate UNII-ZYU8S7C4T7,AI3-33574 Decanoic acid
	A decanoate ester obtained by the formal condensation of the carboxy group of decanoc acid (capric acid) with the alcoholic hydroxy group of isobutanol.
T22364	Methyl 4-aminobutyrate HCl 4-氨基丁酸甲酯盐酸盐,Methyl 4-aminobutyrate hydrochloride,GABA methyl ester	Others	Others
	Methyl 4-aminobutyrate HCl (GABA methyl ester) 是一种由氨基丁酸和甲醇缩合而成的甲酯化合物。
T5651	Phenyl benzoate	Others	Others
	Phenyl benzoate 是苯酚与苯甲酸缩合而成的苯甲酸酯，是重要的有机合成中间体。
T13623	Compound 48/80 trihydrochloride C48/80 trihydrochloride	Phospholipase	Metabolism
	Compound 48/80 trihydrochloride (C48/80 trihydrochloride) 是 N-甲基对甲氧基苯乙胺和甲醛发生缩合反应后的混合物。Compound 48/80 trihydrochloride 是一种肥大细胞 (mast cell) 脱颗粒剂和组胺 (histamine) 释放剂。Compound 48/80 trihydrochloride 对人血小板磷脂酰肌醇特异性磷脂酶 C (phosphatidylinositol-specific phospholipase C) 活性有抑制作用。
T7739	L-Leucyl-L-Leucine methyl ester hydrochloride Leu-Leu-ome hydrochloride	Others; Endogenous Metabolite	Metabolism; Others
	L-Leucyl-L-Leucine methyl ester hydrochloride (Leu-Leu-ome hydrochloride) 是一种人单核细胞或多形核白细胞产生的 L-亮氨酸甲酯的二肽缩合产物，能够选择性消除具有细胞毒性潜能的淋巴细胞，也能够诱导溶酶体途径应激。
T36879L	H-Leu-Leu-OMe . HBr H-Leu-Leu-OMe . HBr (16689-14-8 Free base)	Others	Others
	H-Leu-Leu-OMe . HBr 是由人单核细胞或多形核白细胞产生的L-亮氨酸甲酯的二肽缩合产物。 H-Leu-Leu-OMe . HBr 诱导内溶酶体途径应激并选择性地消除具有细胞毒性潜力的淋巴细胞。
T2186	Tris(2,2,2-trifluoroethyl) borate SL 75212,硼酸三酯(2,2,2-三氟乙基)	Others	Others
	Tris(2,2,2-trifluoroethyl) borate (SL 75212) 主要用于缩合反应。它已被证明可以促进羧酸和胺直接形成酰胺，以及胺或酰胺与羰基化合物形成亚胺。
T20334	Furoin NSC 18522,NSC18522,NSC-18522
	Furoin is an organic compound. It can be produced from furfural by a benzoin condensation reaction catalyzed by cyanide ions.
T32600	Lauroylmethionine N-Lauroyl-L-methionine,Lauroyl-L-methionine
	Lauroylmethionine is a lysine salt of the product formed by the condensation of lauroyl fatty acid chloride with methionine.
T20780	Dibutyltin maleate Stavinor Sn 1300,Stavinor 1300SN
	Dibutyltin maleate is used as a condensation catalyst and pvc Stabilizer.
T74039	Arachidonoyl coenzyme A lithium
	Arachidonoyl coenzyme A lithium是一种由辅酶A的硫醇基与花生四烯酸的羧基缩合生成的不饱和脂肪酰基辅酶A。
T38132	(S)-Higenamine hydrobromide
	(S)-Higenamine hydrobromide, an S-enantiomer of Higenamine, serves as the preliminary compound in benzylisoquinoline alkaloid biosynthesis. It is formed through the condensation of dopamine and 4-hydroxyphenylacetaldehyde (4-HPAA) via norcoclaurine synthase (NCS)[1].
T9538	3,5-Di-tert-butylbenzaldehyde	Others	Others
	3,5-Di-tert-butylbenzaldehyde 可用于合成化合物。
T35454	γ-Glu-Cys (ammonium salt)
	γ-Glu-Cys is an intermediate in glutathione (GSH) synthesis.1It is formed by ATP-dependent condensation of cysteine and glutamate by γ-glutamylcysteine synthetase. γ-Glu-Cys is also an essential component of phytochelatins, the heavy metal detoxifying enzymes in plants.2
T73753	Neuraminic acid
	Neuraminic acid是由9个碳原子的主链构成的酸性氨基糖，也是丙酮酸与D-甘露胺(2-氨基-2-脱氧甘露糖)醛酸经缩合反应生成的产物。它作为具有生物活性的黏液蛋白的官能团。
T75641	(S)-Higenamine
	(S)-Higenamine ((S)-Norcoclaurine)，一种苄基异喹啉生物碱，作为其生物合成路径中的起始化合物，通过去甲月桂碱合酶(NCS)催化多巴胺与4-羟基苯乙醛(4-HPAA)的缩合反应形成。
T37584	Tryptoquivaline D
	Tryptoquivaline D is a fungal metabolite that has been found inNeosartorya siamensisand has anticancer activity.1,2It induces nuclear chromatin condensation, a marker of apoptosis, in HCT116 colon and HepG2 liver cancer cells when used at a concentration of 150 μM.1Tryptoquivaline D (1-100 μM), alone or in combination with doxorubicin , reduces the viability of A549 lung cancer cells.2
T83949	DC 432
	DC 432是一种强效的N-terminal methyltransferase 1/2 (NTMT1/2) (IC50= 54 nM)肽模拟抑制剂，含有BM30肽和额外五个精氨酸残基。在HCT116细胞中，DC 432处理能够降低调节染色体凝缩1和SET蛋白的N端甲基化水平。该化合物具有细胞渗透性。
T76165	N-Acetylneuraminate lyase (CgNal)
	N-Acetylneuraminate lyase (CgNal)（亦称Sialic acid aldolase (CgNal)）是一种醛缩酶，在生化研究中有着广泛应用。该酶催化丙酮酸和N-acetyl-d-mannosamine (ManNAc) 通过一种可逆的缩合反应生成sialic acid N-acetylneuraminic acid (Neu5Ac)。
T70770	Cyclazosin Free Base
	Cyclazosin Free Base is a monocarboxylic acid amide obtained by formal condensation of the carboxy group of furoic acid with the secondary amino group of 6,7-dimethoxy-2-[(4aR,8aS)-octahydroquinoxalin-1-yl]quinazolin-4-amine. It has a role as an adenosine A2A receptor antagonist. It is a member of quinazolines, a member of furans, an aromatic ether, a quinoxaline derivative, an aromatic amide and a monocarboxylic acid amide.
T78520	CYT296	Others	Others
	CYT296是一种靶向染色质去凝集的化合物，能增强定义因子(OSKM)介导诱导多能干细胞(iPSC)的生成，并通过诱导小鼠胚胎成纤维细胞(MEFs)染色质的开放状态来促进体细胞的重编程，适用于细胞替代治疗和药物筛选的研究领域。
T36731	Cholesteryl Heptadecanoate
	Cholesteryl heptadecanoate is a cholesterol ester (CE) formed by the condensation of cholesterol with heptadecanoic acid, a C-17 saturated fatty acid that does not occur in any natural animal or vegetable fat at high concentrations. As such, it is commonly used as an internal standard for the quantification of cholesterol esters by GC- or LC-mass spectrometry. CEs are major constituents of lipoprotein particles carried in blood and accumulate in the fatty acid lesions of atherosclerotic plaques....
T83886	icFSP1 TFA
	icFSP1是一种抑制剂，针对的是铁死亡抑制蛋白1（FSP1）。在2.5 µM的浓度下使用时，能够引发FSP1在细胞中的凝聚和相分离，但在无细胞测试中并不抑制FSP1的酶活性（IC50 = > 30 µM）。icFSP1以浓度依赖的方式诱导HT-1080纤维肉瘤细胞的铁死亡。在体内，icFSP1（50 mg/kg）通过使用人类过表达FSP1，Gpx4-/-Fsp1-/-的B16/F10细胞，在B16/F10鼠黑色素瘤模型中减少肿瘤体积和重量。
T83713	DC432 TFA
	DC432是一种细胞内可渗透的肽类抑制剂，针对N-末端Xaa-Pro-Lys N-甲基转移酶1 (NTMT1; IC50 = 0.054 µM)。该化合物与NTMT1和NTMT2有结合作用（Kds分别为0.3和1 µM），并在10和50 µM的浓度下，通过细胞外实验抑制NTMT1对调节染色体凝缩1 (RCC1) N-末端二甲基化。DC432（100 µM）在HCT116细胞中减少了RCC1 SPKRIA基序的三甲基化。
T78855	Anticancer agent 157	NO Synthase	Immunology/Inflammation
	Anticanceragent 157（compound 15）是一种NO抑制剂，具有抗炎和抗癌特性，IC50值为0.62 μg/mL。它能够与iNOS和caspase 8结合，进而导致核断裂和染色质浓缩，从而诱导细胞凋亡。此外，Anticanceragent 157在不同癌细胞系中展现出显著的抑制活性，对HT29结肠癌细胞的IC50为2.45 μg/mL，对Hep-G2肝癌细胞的IC50为3.25 μg/mL，以及对B16-F10鼠黑色素瘤细胞的IC50为3.84 μg/mL。

化合物

2,2′-Dipyridyl disulfide

Cat.No: T19780

Synonym: 2,2'-Dipyridyl disulfide,OPSS,2,2'-二硫二吡啶,Aldrithiol 2,Orthopyridyl disulfide

Target: Others

Emamectin Benzoate

Cat.No: T15212

Synonym: MK-244,甲胺基阿维菌素苯甲酸盐

Target: Apoptosis, Reactive Oxygen Species, GABA Receptor, Parasite

Glycylsarcosine

Cat.No: T8915

Synonym: GLYCYL-SARCOSINE,甘氨酰肌氨酸

Target: Others

Isobutyl decanoate

Cat.No: T21223

Synonym: UNII-ZYU8S7C4T7,AI3-33574 Decanoic acid

Methyl 4-aminobutyrate HCl

Cat.No: T22364

Synonym: 4-氨基丁酸甲酯盐酸盐,Methyl 4-aminobutyrate hydrochloride,GABA methyl ester

Target: Others

Phenyl benzoate

Cat.No: T5651

Target: Others

Compound 48/80 trihydrochloride

Cat.No: T13623

Synonym: C48/80 trihydrochloride

Target: Phospholipase

L-Leucyl-L-Leucine methyl ester hydrochloride

Cat.No: T7739

Synonym: Leu-Leu-ome hydrochloride

Target: Others, Endogenous Metabolite

H-Leu-Leu-OMe . HBr

Cat.No: T36879L

Synonym: H-Leu-Leu-OMe . HBr (16689-14-8 Free base)

Target: Others

Tris(2,2,2-trifluoroethyl) borate

Cat.No: T2186

Synonym: SL 75212,硼酸三酯(2,2,2-三氟乙基)

Target: Others

Cat.No: T20334

Synonym: NSC 18522,NSC18522,NSC-18522

Lauroylmethionine

Cat.No: T32600

Synonym: N-Lauroyl-L-methionine,Lauroyl-L-methionine

Dibutyltin maleate

Cat.No: T20780

Synonym: Stavinor Sn 1300,Stavinor 1300SN

Arachidonoyl coenzyme A lithium

Cat.No: T74039

(S)-Higenamine hydrobromide

Cat.No: T38132

3,5-Di-tert-butylbenzaldehyde

Cat.No: T9538

Target: Others

γ-Glu-Cys (ammonium salt)

Cat.No: T35454

Neuraminic acid

Cat.No: T73753

Cat.No: T75641

Tryptoquivaline D

Cat.No: T37584

Cat.No: T83949

N-Acetylneuraminate lyase (CgNal)

Cat.No: T76165

Cyclazosin Free Base

Cat.No: T70770

Cat.No: T78520

Target: Others

Cholesteryl Heptadecanoate

Cat.No: T36731

Cat.No: T83886

Cat.No: T83713

Anticancer agent 157

Cat.No: T78855

Target: NO Synthase

Cat. No.	Product Name	Target	Signaling Pathways
T8042	2-Acetylthiazole 2-Acetylthiazole;2 Acetylthiazole,2-Acetylthiazole,2-Thiazolyl methyl ketone,2 Acetylthiazole,1-(2-Thiazolyl)ethanone	Others	Others
	2-Acetylthiazole (2-Acetylthiazole;2 Acetylthiazole) 用于制备手性醇、三唑并噻唑，也用于羟醛缩合反应。
T37298	Spinacine	Endogenous Metabolite	Metabolism
	Spinacine 是人内源性代谢产物。
T1705	5-Amino-3H-imidazole-4-Carboxamide 4-Amino-5-imidazolecarboxamide,AICA,4-氨基-5-咪唑甲酰胺,5-Aminoimidazole-4-carboxamide	Endogenous Metabolite	Metabolism
	5-Amino-3H-imidazole-4-Carboxamide (AICA) 是一种合成嘌呤（尤其是核碱基腺嘌呤和鸟嘌呤）的重要前体。
T1353	DL-Mevalonolactone 甲瓦龙酸内酯,Mevalonolactone	Others; Endogenous Metabolite	Metabolism; Others
	DL-Mevalonolactone (Mevalonolactone)，一种人内源性代谢物，是甲羟戊酸的 δ-lactone 形式，甲羟戊酸途径的一个前体。它能够降低大脑中线粒体膜电位(∆Ψm)，Ca2+的保留能力和 NAD (P) H 的含量 , 而且还诱导线粒体肿胀。
T19316	Ethyl oleate	Others	Others
	Ethyl oleate 是由油酸和乙醇的缩合形成的脂肪酸酯。它是纳米结构脂质载体 (NLC) 中的液体脂质成分。其中 NLC 是一种口服有活性的反式阿魏酸的给药载体。
T5238	1,2-Dipalmitoyl-sn-glycero-3-phosphoethanolamine 1,2-Dipalmitoyl-sn-glycero-3-PE,L-磷脂酰乙醇胺,1,2-Dipalmitoyl-sn-glycerol-3-Phosphoethanolamine,1,2-DPPE	Others; Endogenous Metabolite	Metabolism; Others
	1,2-Dipalmitoyl-sn-glycero-3-phosphoethanolamine (DPPE) 是内源性代谢产物的一种。
T6S2391	L-Chicoric Acid (-)-Chicoric acid,trans-Caffeoyltartaric acid,Chicoric acid,L-菊苣酸,dicaffeoyltartaric acid,菊苣酸	Others; HIV Protease	Microbiology/Virology; Others; Proteases/Proteasome
	L-Chicoric Acid (trans-Caffeoyltartaric acid) 是一种二咖啡酰酒石酸，是一种选择性可逆的 HIV-1 整合酶抑制剂，IC50约为 100 nM。它还可抑制 HIV-1 复制。
T75639	Cellohexaose
	Cellohexaose，一种由β(1-4)链接的D-葡萄糖单体通过缩合反应形成的葡萄糖聚合物，来源于纤维素的分解，包含两个或更多的葡萄糖单体。

天然产物

2-Acetylthiazole

Cat.No: T8042

Synonym: 2-Acetylthiazole;2 Acetylthiazole,2-Acetylthiazole,2-Thiazolyl methyl ketone,2 Acetylthiazole,1-(2-Thiazolyl)ethanone

Target: Others

Cat.No: T37298

Target: Endogenous Metabolite

5-Amino-3H-imidazole-4-Carboxamide

Cat.No: T1705

Synonym: 4-Amino-5-imidazolecarboxamide,AICA,4-氨基-5-咪唑甲酰胺,5-Aminoimidazole-4-carboxamide

Target: Endogenous Metabolite

DL-Mevalonolactone

Cat.No: T1353

Synonym: 甲瓦龙酸内酯,Mevalonolactone

Target: Others, Endogenous Metabolite

Cat.No: T19316

Target: Others

1,2-Dipalmitoyl-sn-glycero-3-phosphoethanolamine

Cat.No: T5238

Synonym: 1,2-Dipalmitoyl-sn-glycero-3-PE,L-磷脂酰乙醇胺,1,2-Dipalmitoyl-sn-glycerol-3-Phosphoethanolamine,1,2-DPPE

Target: Others, Endogenous Metabolite

L-Chicoric Acid

Cat.No: T6S2391

Synonym: (-)-Chicoric acid,trans-Caffeoyltartaric acid,Chicoric acid,L-菊苣酸,dicaffeoyltartaric acid,菊苣酸

Target: Others, HIV Protease

Cat.No: T75639

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