Ganoderic acid Z
HIT218848095
sdf文件结构编辑类似物检索
HIT ID: HIT218848095
Cas No: 86420-19-1
分子式: C30H48O3
分子量: 456.711
常用名: Ganoderic acid Z
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2E,6R)-6-[(1R,3aR,5aR,7S,9aS,11aR)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
IUPAC: (2E,6R)-6-[(1R,3aR,5aR,7S,9aS,11aR)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
SMILES: [H][C@@]1(CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])CC3)[C@H](C)CC\C=C(/C)C(O)=O
SMILES: [H][C@@]1(CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])CC3)[C@H](C)CC\C=C(/C)C(O)=O
InChI key: KGELVXQPIUKGCO-SPPZYOJVSA-N
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