Name: (25S)-Antcin B
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218851568
Cas No:1312711-71-9
常用名:(25S)-Antcin B
IUPAC:(2S,6R)-6-[(1R,3aR,5aS,6S,9aS,11aR)-6,9a,11a-trimethyl-4,7,10-trioxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-methylideneheptanoic acid
IUPAC:(2S,6R)-6-[(1R,3aR,5aS,6S,9aS,11aR)-6,9a,11a-trimethyl-4,7,10-trioxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-methylideneheptanoic acid
InChI key:DVORYMAGXQGBQK-HPRYJKPLSA-N

分子式:C29H40O5
分子量:468.634
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]1(CC[C@@]2([H])C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)[C@@H](C)[C@]1([H])CC3=O)[C@H](C)CCC(=C)[C@H](C)C(O)=O
SMILES:[H][C@@]1(CC[C@@]2([H])C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)[C@@H](C)[C@]1([H])CC3=O)[C@H](C)CCC(=C)[C@H](C)C(O)=O

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