Name: Mollugogenol A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214318561
Cas No:22550-76-1
常用名:Mollugogenol A
IUPAC:(3aS,4S,5aR,5bR,7S,7aR,9S,11aR,11bR,13aR,13bR)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-icosahydro-1H-cyclopenta[a]chrysene-4,7,9-triol
IUPAC:(3aS,4S,5aR,5bR,7S,7aR,9S,11aR,11bR,13aR,13bR)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-icosahydro-1H-cyclopenta[a]chrysene-4,7,9-triol
InChI key:USLXSBTYECTZSS-CTAPIYMESA-N

分子式:C30H52O4
分子量:476.742
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C(CC[C@]1(C)[C@@]1([H])CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])[C@@H](O)C[C@@]3(C)[C@]1(C)C[C@@H]2O)C(C)(C)O |@:34|
SMILES:[H][C@]12C(CC[C@]1(C)[C@@]1([H])CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])[C@@H](O)C[C@@]3(C)[C@]1(C)C[C@@H]2O)C(C)(C)O |@:34|

Mollugogenol A is a Gammacerane from Mollugo pentaphylla. It is an antifungal saponin with spermatocidal activity. Mollugogenol A also involves sperm membrane damage by increased lipid peroxidation.

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