2-Hydroxyalantolactone
HIT101447119
sdf文件结构编辑类似物检索
HIT ID: HIT101447119
Cas No: 68776-45-4
分子式: C15H20O3
分子量: 248.322
常用名: 2-Hydroxyalantolactone
氢键受体数 (HBA): 2
氢键供体数 (HBD): 1
LogP: 1.913
IUPAC: (3aR,5S,7S,8aR,9aR)-7-hydroxy-5,8a-dimethyl-3-methylidene-2H,3H,3aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
IUPAC: (3aR,5S,7S,8aR,9aR)-7-hydroxy-5,8a-dimethyl-3-methylidene-2H,3H,3aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
SMILES: C[C@H]1C[C@H](O)C[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12 |t:17|
SMILES: C[C@H]1C[C@H](O)C[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12 |t:17|
InChI key: FZSKLHDEGWSLTB-ATYMOLOSSA-N
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