Fern-7-en-19-one
HIT214315900
sdf文件结构编辑类似物检索
HIT ID: HIT214315900
Cas No: 222294-61-3
分子式: C30H48O
分子量: 424.713
常用名: Fern-7-en-19-one
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3aR,5aS,7aS,11aS,11bR,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-3-(propan-2-yl)-1H,2H,3H,3aH,4H,5H,5aH,7H,7aH,8H,9H,10H,11H,11aH,11bH,12H,13H,13aH,13bH-cyclopenta[a]chrysen-1-one
IUPAC: (3aR,5aS,7aS,11aS,11bR,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-3-(propan-2-yl)-1H,2H,3H,3aH,4H,5H,5aH,7H,7aH,8H,9H,10H,11H,11aH,11bH,12H,13H,13aH,13bH-cyclopenta[a]chrysen-1-one
SMILES: [H][C@@]12C(=O)CC(C(C)C)[C@@]1(C)CC[C@]1(C)C3=CC[C@@]4([H])C(C)(C)CCC[C@]4(C)[C@@]3([H])CC[C@@]21C |t:16,@:6|
SMILES: [H][C@@]12C(=O)CC(C(C)C)[C@@]1(C)CC[C@]1(C)C3=CC[C@@]4([H])C(C)(C)CCC[C@]4(C)[C@@]3([H])CC[C@@]21C |t:16,@:6|
InChI key: YGXDNAKJACTKPU-LTHKBICASA-N
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