8-Epiivangustin
HIT213123750
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HIT ID: HIT213123750
Cas No: 68776-48-7
分子式: C15H20O3
分子量: 248.322
常用名: 8-Epiivangustin
氢键受体数 (HBA): 2
氢键供体数 (HBD): 1
LogP: 2.026
IUPAC: (3aR,8R,8aR,9aS)-8-hydroxy-5,8a-dimethyl-3-methylidene-2H,3H,3aH,4H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
IUPAC: (3aR,8R,8aR,9aS)-8-hydroxy-5,8a-dimethyl-3-methylidene-2H,3H,3aH,4H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
SMILES: CC1=C2C[C@H]3[C@H](C[C@@]2(C)[C@H](O)CC1)OC(=O)C3=C |c:1|
SMILES: CC1=C2C[C@H]3[C@H](C[C@@]2(C)[C@H](O)CC1)OC(=O)C3=C |c:1|
InChI key: BGEGQRAHHFWWJT-CQROYNQRSA-N
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