Ethyl ganoderate J
HIT214312960
sdf文件结构编辑类似物检索
HIT ID: HIT214312960
Cas No: 1189555-95-0
分子式: C32H46O7
分子量: 542.713
常用名: Ethyl ganoderate J
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: ethyl (2R)-6-[(1R,3S,3aR,9aS,11aR)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-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-4-oxoheptanoate
IUPAC: ethyl (2R)-6-[(1R,3S,3aR,9aS,11aR)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-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-4-oxoheptanoate
SMILES: CCOC(=O)[C@H](C)CC(=O)CC(C)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O |c:19|
SMILES: CCOC(=O)[C@H](C)CC(=O)CC(C)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O |c:19|
InChI key: MOGCKMACSLYDKK-DLBHLBNGSA-N
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