Name: Gambogic Acid
Rating: 5 (10 reviews)

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HIT ID:HIT212651112
Cas No:2752-65-0
常用名:Gambogic Acid
别名:藤黄酸 A, 藤黄酸, Guttic Acid, Guttatic Acid, Beta-Guttiferrin
别名:藤黄酸 A, 藤黄酸, Guttic Acid, Guttatic Acid, Beta-Guttiferrin
IUPAC:(2Z)-4-[(1S,2S,8R,17S,19R)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0^{2,15}.0^{2,19}.0^{4,13}.0^{6,11}]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
IUPAC:(2Z)-4-[(1S,2S,8R,17S,19R)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0^{2,15}.0^{2,19}.0^{4,13}.0^{6,11}]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
InChI key:GEZHEQNLKAOMCA-RRZNCOCZSA-N

分子式:C38H44O8
分子量:628.762
氢键供体数 (HBD):2
氢键受体数 (HBA):8
LogP:7.783757
SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]1([#6])[#8]-c2c(-[#6]\[#6]=[#6](/[#6])-[#6])c3-[#8][C@@]45[#6@H]6-[#6]-[#6@@H](-[#6]=[#6]4-[#6](=O)-c3c(-[#8])c2-[#6]=[#6]1)-[#6](=O)[C@]5([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)[#8]C6([#6])[#6] |c:22,33,TLB:22:21:18:42.43,THB:43:19:22.23:32.34|
SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]1([#6])[#8]-c2c(-[#6]\[#6]=[#6](/[#6])-[#6])c3-[#8][C@@]45[#6@H]6-[#6]-[#6@@H](-[#6]=[#6]4-[#6](=O)-c3c(-[#8])c2-[#6]=[#6]1)-[#6](=O)[C@]5([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)[#8]C6([#6])[#6] |c:22,33,TLB:22:21:18:42.43,THB:43:19:22.23:32.34|

Gambogic Acid (Standard) 是 Gambogic Acid 的标准品。适用于定量分析、质量控制及生化实验等相关研究。Gambogic Acid (Guttic Acid) 是来自藤黄树的一种藤黄树脂，抑制 Bcl-XL、Bcl-2、Bcl-W、Bcl-B、Bfl-1和 Mcl-1，IC50分别为 1.47 μM、1.21 μM、2.02 μM、0.66 μM、1.06 μM 和 0.79 μM。

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