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2

抑制剂 & 化合物

65

天然产物

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Cat. No.	Product Name	Target	Signaling Pathways
T20607	3-Oxo-3-phenylpropene Phenylvinylketone,Phenyl vinyl ketone,Phenylvinyl ketone,3 Oxo 3 phenylpropene
	3-Oxo-3-phenylpropene is an active-site directed irreversible inhibitor of hydroxynitrile lyase.
T20325	Butyl cinnamate NSC71966,NSC-71966,NSC 71966
	Butyl cinnamate is an agent of mosquito repellent.

化合物

3-Oxo-3-phenylpropene

Cat.No: T20607

Synonym: Phenylvinylketone,Phenyl vinyl ketone,Phenylvinyl ketone,3 Oxo 3 phenylpropene

Butyl cinnamate

Cat.No: T20325

Synonym: NSC71966,NSC-71966,NSC 71966

Cat. No.	Product Name	Target	Signaling Pathways
T3939	Benzoin Benzoylphenylcarbinol,安息香	Others	Others
	Benzoin (Benzoylphenylcarbinol) 是一种从安息香科中分离得到的香树脂，可用作植物的颜色添加剂。
T7925	Methyl benzoin 安息香甲基醚,Benzoin methyl ether	Others	Others
	Methyl benzoin (Benzoin methyl ether) 是一种生化物质。
T0144	Ftaxilide Histanorm,安息香酸,伏保克西里	Antibacterial	Microbiology/Virology
	Ftaxilide (Histanorm) 是新型抗结核剂。
T8000	2-Isopropoxy-2-Phenylacetophenone	Others	Others
	2-Isopropoxy-2-Phenylacetophenone 是一种天然化合物，安息香的衍生物。安息香是一种天然存在的苯甲醛，存在于许多植物中。
TC0026	Testosterone benzoate	Others	Others
	Testosterone benzoate 是一种合成的注射合成代谢雄激素类固醇 (AAS) 和一种雄激素酯。
T23107	Ononetin 芒柄花酚,2',4'-Dihydroxy-2-(4-methoxyphenyl)acetophenone	TRP/TRPV Channel	Membrane transporter/Ion channel
	Ononetin (2',4'-Dihydroxy-2-(4-methoxyphenyl)acetophenone) 是天然脱氧安息香素，是有效的TRPM3 通道选择性阻断剂，IC50为 0.3 μM。
TN2241	Styraxlignolide F	Others	Others
	Styraxlignolide F 是一种分离自 Styrax japonica 天然产物。
T8025	Phenylglyoxylic acid Benzoyl formate,Phenylglyoxalic acid,苯甲酰甲酸,Phenylglyoxylate	Others; Endogenous Metabolite	Metabolism; Others
	Phenylglyoxylic acid (Benzoyl formate) 是一种乙苯和苯乙烯 (EB/S) 的代谢物，能够被用作人体暴露于 EB/S 的生物标志物。
TN1438	beta-Amyrin acetate beta-香树脂醇乙酸酯	Antioxidant; HMG-CoA Reductase; Epoxide Hydrolase; Antifungal	Metabolism; Microbiology/Virology; oxidation-reduction
	beta-Amyrin acetate 抑制 HMG-CoA 还原酶 (HMGCR) 和 sEH 活性，IC50 为 3.4 μM。 beta-Amyrin acetate 具有抗炎、抗真菌、抗氧化和抗高血脂活性。
T1311	4-aminobenzoic acid PABA,Vitamin H1,Vitamin Bx,para-Aminobenzoic acid,对氨基苯甲酸	Endogenous Metabolite	Metabolism
	4-aminobenzoic acid (para-Aminobenzoic acid) 是一种具有紫外线吸收和抗纤维化特性的有机酸。当暴露在光线下时，4-aminobenzoic acid 吸收紫外线并通过光化学反应释放多余的能量，这可能会对DNA造成损害。4-aminobenzoic acid 还可以增加组织水平的摄氧量，并可能增强单胺氧化酶(MAO)活性以促进血清素的降解，过量可能导致纤维化变化。
TN3849	Dihydrodehydrodiconiferyl alcohol	TNF	Apoptosis
	Dihydrodehydrodiconiferyl alcohol 是 Liriodendron tulipifera 的甲醇提取物。
T0051	Urethane Ethyl carbamate,Ethylurethane,Carbamic acid ethyl ester,氨基甲酸乙酯	Chloride channel; GABA Receptor; Antibacterial; GluR; NMDAR; AChR; Parasite	Membrane transporter/Ion channel; Microbiology/Virology; Neuroscience
	Urethane (Ethylurethane) 是多种食品中发酵形成的副产物，是氨基甲酸的乙酯，具有抑制细菌、海胆卵、原生动物和植物组织生长的作用。
T3750	4-Hydroxyacetophenone 对羟基苯乙酮,4-Acetylphenol,Piceol,p-Acetylphenol,4'-Hydroxyacetophenone	HBV; Xanthine Oxidase	Metabolism; Microbiology/Virology
	4-Hydroxyacetophenone (4-Acetylphenol) 是蒿属植物和木香属植物中的一种黄嘌呤氧化酶抑制剂，具有保肝促胆、抗乙型肝炎病毒和抗炎作用。
TWS1563	Incensole	Others	Others
	Incensole 是一种 14-membered 二萜类化合物，分离自烯属植物的香精油和乳香树脂中。它能够激活脑中离子通道，并可以缓解焦虑或抑郁，从而显示出抗炎和抗抑郁的特性。
T3S0507	Homovanillic acid Homovaniuic acid,Vanilacetic acid,高香草酸,Vanillacetic acid	Others; Endogenous Metabolite	Metabolism; Others
	Homovanillic acid (Vanillacetic acid) 是一种多巴胺代谢物，它与乳糜泻、生长激素缺乏、芳香族氨基酸脱羧酶缺乏症以及脂联素还原酶缺乏症相关。
T2784	Ethyl Orsellinate 苷色酸乙酯,山梨酸乙酯,Orsellinic acid ethyl ester	Others; Antibacterial	Microbiology/Virology; Others
	Ethyl Orsellinate (Orsellinic acid ethyl ester) 是地衣代谢产物，抑制A.salina 的细胞毒性活性，IC50为 495 μM。它是 lecanoric acid 的衍生物，具有抗增殖和抗肿瘤活性。
T8031	Terephthalic acid	Others; Endogenous Metabolite	Metabolism; Others
	Terephthalic acid 是一种三种酞酸盐的异构体，是聚酯 PET 的前体，能够用于制作服装和塑料。
TN1257	3-O-Acetyl-α-boswellic acid 3-O-Acetyl-alpha-boswellic acid,α-Boswellic acid acetate,乙酰基-ALPHA-乳香酸	Prostaglandin Receptor	GPCR/G Protein; Immunology/Inflammation
	3-O-Acetyl-α-boswellic acid (α-Boswellic acid acetate) 能够抑制 T 细胞功能，具有很强的抗炎作用。
T5552	Methyl cinnamate	Tyrosinase; Antibacterial; AMPK	Chromatin/Epigenetic; Microbiology/Virology; PI3K/Akt/mTOR signaling; Proteases/Proteasome
	Methyl cinnamate 是花椒的有效成分，也是一种天然香料。它是一种防止食品褐变的酪氨酸酶抑制剂，具有抗菌活性。它通过由 CaMKK2-AMPK 信号途径介导的机制具有抗脂活性。
TN1258	3-Acetyl-beta-boswellic acid 3-O-Acetyl-beta-boswellic acid,3-乙酰基-BETA-乳香酸	DNA/RNA Synthesis	Cell Cycle/Checkpoint; DNA Damage/DNA Repair
	3-Acetyl-beta-boswellic acid 是一种乳香酸，分离自乳香锯缘胶树脂。
T4010	Juglone 5-羟基对萘醌,5-Hydroxy-1,4-naphthoquinone,胡桃酮,Regianin	DNA/RNA Synthesis; Antibacterial	Cell Cycle/Checkpoint; DNA Damage/DNA Repair; Microbiology/Virology
	Juglone (Regianin) 是一种从黑胡桃Juglans regia 中发现的黄色染料，有抗菌作用。
T0449	Menadione 维生素K3,Vitamin K3,甲萘醌	Thrombin; Endogenous Metabolite	Metabolism; Proteases/Proteasome
	Menadione (Vitamin K3) 是合成的萘醌，能够在体内转化成活性维生素 K2。
T5883	4-Ethylphenol	Others; Endogenous Metabolite	Metabolism; Others
	4-Ethylphenol 是与酒中的气味相关的挥发性酚类物质。
TN1500	Cinnamyl cinnamate Phenylallyl cinnamate
	Cinnamyl cinnamate (Phenylallyl cinnamate) 是一种天然产物，存在于龙脑丘、白杨中，是可从苏合香脂，白秘鲁香脂中提取出的食用香精。
TN1853	Lariciresinol (+)-落叶松树脂醇	VEGFR; Antifection	Angiogenesis; Microbiology/Virology; Tyrosine Kinase/Adaptors
	Lariciresinol 是一种肠木脂素前体，它通过破坏真菌质膜具有杀真菌活性，并具有作为治疗人类真菌感染性疾病的新型抗真菌剂的治疗潜力。膳食 lariciresinol 可以减缓乳腺肿瘤的生长并降低人 MCF-7 乳腺癌异种移植物和致癌物诱导的大鼠乳腺肿瘤的血管密度。
T3741	(-)-borneol L-Borneol,冰片	GABA Receptor	Membrane transporter/Ion channel; Neuroscience
	(-)-borneol (L-Borneol) 对 GABA 受体具有高效的正向调节作用，EC50 为 237 μM。
T8026	(-)-Limonene l-Limonene,(S)-(−)-Limonene,(-)-柠檬烯	Endogenous Metabolite	Metabolism
	(S)-(-)-Limonene (l-Limonene) 是一种存在多种松针油和松节油中的单萜烯，能轻微的引起支气管收缩。
T0572	Methyl 3,4,5-trimethoxybenzoate Methyl gallate trimethyl ether,Methyl EudesMate,3,4,5-Trimethoxybenzoic acid methyl ester,Methyl tri-O-methylgallate,甲氧苄啶杂质H,Trimethylgallic acid methyl ester	Others	Others
	Methyl 3,4,5-trimethoxybenzoate (Methyl EudesMate) 是由 Gallic acid 为原料合成得到，常用于生产磺胺增效剂中间体、甲氧苄氨嘧啶 (TMP)以及许多其它药物。
TN2965	3'-Nitroacetophenone	Others	Others
	3'-Nitroacetophenone 是一种天然产物，可用于生命科学领域的相关研究。其产品编号为 TN2965，CAS号为 121-89-1。
T5S1550	Cinnamyl alcohol 肉桂醇,肉桂醇；beta-苯丙烯醇,Cinnamic Alcohol,Styryl Carbinol	PPAR	DNA Damage/DNA Repair; Metabolism
	Cinnamyl alcohol (Styryl Carbinol) 是从板栗花中分离得到的一种活性成分，抑制增加的 PPARγ表达，具有抗肥胖作用。
TN6832	Sulcatone 6-甲基-5-庚烯-2-酮,6-methylhept-5-en-2-one,6-Methyl-5-hepten-2-one	Endogenous Metabolite	Metabolism
	Sulcatone (6-Methyl-5-hepten-2-one) 是内源性代谢产物的一种。
TQ0089	Juglanin	Apoptosis; JNK; Autophagy	Apoptosis; Autophagy; MAPK
	Juglanin 是来自金鸡脚的一种黄酮类天然产物，是一种 JNK 的激活剂，能诱导人乳腺癌细胞的凋亡和自噬，具有炎症和抗肿瘤活性。
TN1915	Matairesinol 4′-O-β-D-glucopyranoside Matairesinol 4'-O-beta-gentiobioside,罗汉松树脂酚-4'-O-Β-龙胆二糖苷,(3R-反式)-3-[[4-[(6-O-BETA-D-吡喃葡萄糖基-BETA-D-吡喃葡萄糖基)氧基]-3-甲氧基苯基]甲基]二氢-4-[(4-羟基-3-甲氧基苯基)甲基]-2(3H)-呋喃酮	Others	Others
	Matairesinol 4′-O-β-D-glucopyranoside 对 HeLa 细胞具有细胞毒活性(IC50:47.1 μM)。
TN4507	Matairesinoside	Others	Others
	Matairesinoside is a natural product from Styrax japonica.
T5653	Cinnamyl acetate 3-Phenylallyl acetate,乙酸桂酯	Others	Others
	Cinnamyl acetate (3-Phenylallyl acetate) 是一种新型广谱抗菌剂，广泛应用于香料和香料工业。
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。
T5615	Benzyl acetate Phenylmethyl acetate,乙酸苄酯,Benzyl ethanoate	Others	Others
	Benzyl acetate 是茉莉、依兰和橙花精油的成分之一。它的天然来源包括各种花（如茉莉花）和各种水果（如梨、苹果）。
T3794	Pentagalloylglucose Penta-O-galloyl-β-D-glucose,1,2,3,4,6-O-Pentagalloylglucose,1,2,3,4,6-Penta-O-galloyl-beta-D-glucopyranose,1,2,3,4,6-五没食子酰葡萄糖	Influenza Virus	Microbiology/Virology
	1,2,3,4,6-O-Pentagalloylglucose (Penta-O-galloyl-β-D-glucose) 存在于多种植物中，具有重要的药理作用。Pentagalloylglucose 表现出显著的抗狂犬病病毒 (RABV) 活性。
T8145	Benzyl cinnamate 肉桂酸苄酯,Benzylcinnamoate,Benzyl 3-phenylpropenoate,Cinnamic acid benzyl ester,Cinnamein	Immunology/Inflammation related	Immunology/Inflammation
	Benzyl cinnamate (Benzylcinnamoate) 是存在于苏门答腊和槟城的苯甲酸中，是存在于秘鲁香脂和托鲁香脂中，可用作香水和固定剂的成分。
TN2448	3α-Hydroxy tirucall-7,24-dien-21-oic acid	Others	Others
	3α-Hydroxy tirucall-7,24-dien-21-oic acid is a natural product from Boswellia carterii Birdw
T38820	Methylsyringin
	Methylsyringin exhibits anti-inflammatory activity in the LPS-stimulated RAW264.7 cells.
TN1764	Incensole acetate	TNF; NF-κB	Apoptosis; NF-κB
	Incensole acetate is a novel anti-inflammatory compound that inhibits NF-κB activation.
T7983	Isoborneol DL-Isoborneol,异冰片,异龙脑	HSV	Microbiology/Virology
	Isoborneol (DL-Isoborneol) 是存在于许多药用植物精油中的一种单萜醇，具有抗氧化和抗病毒特性，是 1 型单纯疱疹病毒(HSV-1)的有效抑制剂。
TN3925	Eichlerianic acid	HSV	Microbiology/Virology
	Eichlerianic acid is a trypanocidal compound with an IC50 value of 10 mg/mL. Eichlerianic acid may have antiviral activity against Herpes simplex virus types I and II in vitro. Eichlerianic acid shows weak cytotoxicity (IC50 6.87 to >40 μM) against human cancer cell (HL-60, SMMC-7721, A-549, MCF-7 and SW480).
TN5402	(-)-Pinoresinol 4-O-glucoside (-)-松脂素 4-O-葡萄糖苷,金银花
	(-)-Pinoresinol 4-O-glucoside is a natural product from Lonicera japonica THUNB.
TN6976	(+)-Pinoresinol monomethyl ether 4-O-β-D-glucoside
	(+)-Pinoresinol monomethyl ether 4-O-β-D-glucoside is a natural product.
T8110	(+)-Longifolene	Endogenous Metabolite	Metabolism
	(+)-Longifolen 是倍半萜类化合物。它也是家兔体内的代谢物，兔子体内转化为伯醇、仲醇或叔醇，其中以伯醇为主。
T20001	Butyl benzoate HSDB 2089,NSC 8474,Benzoic acid, butyl ester,AI3-00521,BRN 1867073
	Butyl benzoate as an involatile solvent, for the sampling of isocyanates with silica gel solid-phase extraction. Butyl benzoate has been used as a preservative in commercial cosmetic lotions.
T3321	Oleanonic acid 3-Oxooleanolic acid,3-Oxoolean-12-en-28-oic Acid,Oleanonic Acid,齐墩果酮酸,3-Ketooleanolic Acid	HIV Protease	Microbiology/Virology; Proteases/Proteasome
	Oleanonic acid (3-Ketooleanolic Acid) 是一种三萜，可以抑制 HIV-1 对细胞的感染。它具有保肝作用，并具有抗肿瘤和抗病毒特性。
TN2844	(2R,3S)-Dihydrodehydroconiferyl alcohol	MAPK; PKC	Chromatin/Epigenetic; Cytoskeletal Signaling; MAPK
	(2R,3S)-Dihydrodehydroconiferyl alcohol can induce neurite outgrowth and enhance NGF-induced neurite outgrowth from PC12 cells by amplifying up-stream steps such as MAPK and PKC.
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天然产物

Cat.No: T3939

Synonym: Benzoylphenylcarbinol,安息香

Target: Others

Cat.No: T7925

Synonym: 安息香甲基醚,Benzoin methyl ether

Target: Others

Cat.No: T0144

Synonym: Histanorm,安息香酸,伏保克西里

Target: Antibacterial

2-Isopropoxy-2-Phenylacetophenone

Cat.No: T8000

Target: Others

Testosterone benzoate

Cat.No: TC0026

Target: Others

Cat.No: T23107

Synonym: 芒柄花酚,2',4'-Dihydroxy-2-(4-methoxyphenyl)acetophenone

Target: TRP/TRPV Channel

Styraxlignolide F

Cat.No: TN2241

Target: Others

Phenylglyoxylic acid

Cat.No: T8025

Synonym: Benzoyl formate,Phenylglyoxalic acid,苯甲酰甲酸,Phenylglyoxylate

Target: Others, Endogenous Metabolite

beta-Amyrin acetate

Cat.No: TN1438

Synonym: beta-香树脂醇乙酸酯

Target: Antioxidant, HMG-CoA Reductase, Epoxide Hydrolase, Antifungal

4-aminobenzoic acid

Cat.No: T1311

Synonym: PABA,Vitamin H1,Vitamin Bx,para-Aminobenzoic acid,对氨基苯甲酸

Target: Endogenous Metabolite

Dihydrodehydrodiconiferyl alcohol

Cat.No: TN3849

Target: TNF

Cat.No: T0051

Synonym: Ethyl carbamate,Ethylurethane,Carbamic acid ethyl ester,氨基甲酸乙酯

Target: Chloride channel, GABA Receptor, Antibacterial, GluR, NMDAR, AChR, Parasite

4-Hydroxyacetophenone

Cat.No: T3750

Synonym: 对羟基苯乙酮,4-Acetylphenol,Piceol,p-Acetylphenol,4'-Hydroxyacetophenone

Target: HBV, Xanthine Oxidase

Cat.No: TWS1563

Target: Others

Homovanillic acid

Cat.No: T3S0507

Synonym: Homovaniuic acid,Vanilacetic acid,高香草酸,Vanillacetic acid

Target: Others, Endogenous Metabolite

Ethyl Orsellinate

Cat.No: T2784

Synonym: 苷色酸乙酯,山梨酸乙酯,Orsellinic acid ethyl ester

Target: Others, Antibacterial

Terephthalic acid

Cat.No: T8031

Target: Others, Endogenous Metabolite

3-O-Acetyl-α-boswellic acid

Cat.No: TN1257

Synonym: 3-O-Acetyl-alpha-boswellic acid,α-Boswellic acid acetate,乙酰基-ALPHA-乳香酸

Target: Prostaglandin Receptor

Methyl cinnamate

Cat.No: T5552

Target: Tyrosinase, Antibacterial, AMPK

3-Acetyl-beta-boswellic acid

Cat.No: TN1258

Synonym: 3-O-Acetyl-beta-boswellic acid,3-乙酰基-BETA-乳香酸

Target: DNA/RNA Synthesis

Cat.No: T4010

Synonym: 5-羟基对萘醌,5-Hydroxy-1,4-naphthoquinone,胡桃酮,Regianin

Target: DNA/RNA Synthesis, Antibacterial

Cat.No: T0449

Synonym: 维生素K3,Vitamin K3,甲萘醌

Target: Thrombin, Endogenous Metabolite

Cat.No: T5883

Target: Others, Endogenous Metabolite

Cinnamyl cinnamate

Cat.No: TN1500

Synonym: Phenylallyl cinnamate

Cat.No: TN1853

Synonym: (+)-落叶松树脂醇

Target: VEGFR, Antifection

Cat.No: T3741

Synonym: L-Borneol,冰片

Target: GABA Receptor

Cat.No: T8026

Synonym: l-Limonene,(S)-(−)-Limonene,(-)-柠檬烯

Target: Endogenous Metabolite

Methyl 3,4,5-trimethoxybenzoate

Cat.No: T0572

Synonym: Methyl gallate trimethyl ether,Methyl EudesMate,3,4,5-Trimethoxybenzoic acid methyl ester,Methyl tri-O-methylgallate,甲氧苄啶杂质H,Trimethylgallic acid methyl ester

Target: Others

3'-Nitroacetophenone

Cat.No: TN2965

Target: Others

Cinnamyl alcohol

Cat.No: T5S1550

Synonym: 肉桂醇,肉桂醇；beta-苯丙烯醇,Cinnamic Alcohol,Styryl Carbinol

Target: PPAR

Cat.No: TN6832

Synonym: 6-甲基-5-庚烯-2-酮,6-methylhept-5-en-2-one,6-Methyl-5-hepten-2-one

Target: Endogenous Metabolite

Cat.No: TQ0089

Target: Apoptosis, JNK, Autophagy

Matairesinol 4′-O-β-D-glucopyranoside

Cat.No: TN1915

Synonym: Matairesinol 4'-O-beta-gentiobioside,罗汉松树脂酚-4'-O-Β-龙胆二糖苷,(3R-反式)-3-[[4-[(6-O-BETA-D-吡喃葡萄糖基-BETA-D-吡喃葡萄糖基)氧基]-3-甲氧基苯基]甲基]二氢-4-[(4-羟基-3-甲氧基苯基)甲基]-2(3H)-呋喃酮

Target: Others

Matairesinoside

Cat.No: TN4507

Target: Others

Cinnamyl acetate

Cat.No: T5653

Synonym: 3-Phenylallyl acetate,乙酸桂酯

Target: Others

Dehydroabietic acid

Cat.No: TCS1772

Synonym: Dehydroabietate,脱氢松香酸

Target: Antifection

Cat.No: T5615

Synonym: Phenylmethyl acetate,乙酸苄酯,Benzyl ethanoate

Target: Others

Pentagalloylglucose

Cat.No: T3794

Synonym: Penta-O-galloyl-β-D-glucose,1,2,3,4,6-O-Pentagalloylglucose,1,2,3,4,6-Penta-O-galloyl-beta-D-glucopyranose,1,2,3,4,6-五没食子酰葡萄糖

Target: Influenza Virus

Benzyl cinnamate

Cat.No: T8145

Synonym: 肉桂酸苄酯,Benzylcinnamoate,Benzyl 3-phenylpropenoate,Cinnamic acid benzyl ester,Cinnamein

Target: Immunology/Inflammation related

3α-Hydroxy tirucall-7,24-dien-21-oic acid

Cat.No: TN2448

Target: Others

Cat.No: T38820

Incensole acetate

Cat.No: TN1764

Target: TNF, NF-κB

Cat.No: T7983

Synonym: DL-Isoborneol,异冰片,异龙脑

Target: HSV

Eichlerianic acid

Cat.No: TN3925

Target: HSV

(-)-Pinoresinol 4-O-glucoside

Cat.No: TN5402

Synonym: (-)-松脂素 4-O-葡萄糖苷,金银花

(+)-Pinoresinol monomethyl ether 4-O-β-D-glucoside

Cat.No: TN6976

(+)-Longifolene

Cat.No: T8110

Target: Endogenous Metabolite

Cat.No: T20001

Synonym: HSDB 2089,NSC 8474,Benzoic acid, butyl ester,AI3-00521,BRN 1867073

Cat.No: T3321

Synonym: 3-Oxooleanolic acid,3-Oxoolean-12-en-28-oic Acid,Oleanonic Acid,齐墩果酮酸,3-Ketooleanolic Acid

Target: HIV Protease

(2R,3S)-Dihydrodehydroconiferyl alcohol

Cat.No: TN2844

Target: MAPK, PKC

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