Name: (20S)-Protopanaxatriol
Rating: 5 (10 reviews)

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HIT ID:HIT212020001
Cas No:34080-08-5
常用名:(20S)-Protopanaxatriol
别名:原人参三醇, g-PPT, 20(S)-APPT, 20 (S)-原人参三醇
IUPAC:(1S,3aR,3bR,5S,5aR,7S,9aR,9bR,11R,11aR)-1-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-5,7,11-triol
IUPAC:(1S,3aR,3bR,5S,5aR,7S,9aR,9bR,11R,11aR)-1-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-5,7,11-triol
InChI key:SHCBCKBYTHZQGZ-CJPZEJHVSA-N

分子式:C30H52O4
分子量:476.742
氢键供体数 (HBD):4
氢键受体数 (HBA):4
LogP:4.223173
SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@]([#6])([#8])[#6@H]-1-[#6]-[#6][C@]2([#6])[#6@@H]-1-[#6@H](-[#8])-[#6]-[#6@@H]1[C@@]3([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]3-[#6@@H](-[#8])-[#6][C@@]21[#6]
SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@]([#6])([#8])[#6@H]-1-[#6]-[#6][C@]2([#6])[#6@@H]-1-[#6@H](-[#8])-[#6]-[#6@@H]1[C@@]3([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]3-[#6@@H](-[#8])-[#6][C@@]21[#6]

(20S)-Protopanaxatriol (Standard) 是 (20S)-Protopanaxatriol 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。(20S)-Protopanaxatriol (g-PPT) 是人参皂苷的代谢物，通过糖皮质激素受体和雌激素受体起作用，同时为LXRα的抑制剂，具有广泛的抗癌活性。

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