24(28)-Dehydroergosterol
HIT214982468
sdf文件结构编辑类似物检索
HIT ID: HIT214982468
Cas No: 29560-24-5
分子式: C28H42O
分子量: 394.643
常用名: 24(28)-Dehydroergosterol
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,3aR,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R,3E)-6-methyl-5-methylidenehept-3-en-2-yl]-1H,2H,3H,3aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
IUPAC: (1R,3aR,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R,3E)-6-methyl-5-methylidenehept-3-en-2-yl]-1H,2H,3H,3aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
SMILES: [H][C@@]12CC[C@H]([C@H](C)\C=C\C(=C)C(C)C)[C@@]1(C)CC[C@@]1([H])C2=CC=C2C[C@@H](O)CC[C@]12C
SMILES: [H][C@@]12CC[C@H]([C@H](C)\C=C\C(=C)C(C)C)[C@@]1(C)CC[C@@]1([H])C2=CC=C2C[C@@H](O)CC[C@]12C
InChI key: SQFQJKZSFOZDJY-CVGLIYDESA-N
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