Santamarine
HIT213885201
sdf文件结构编辑类似物检索
HIT ID: HIT213885201
Cas No: 4290-13-5
分子式: C15H20O3
分子量: 248.322
常用名: Santamarine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-2H,3H,3aH,4H,5H,5aH,6H,7H,9aH,9bH-naphtho[1,2-b]furan-2-one
IUPAC: (3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-2H,3H,3aH,4H,5H,5aH,6H,7H,9aH,9bH-naphtho[1,2-b]furan-2-one
SMILES: CC1=CC[C@@H](O)[C@]2(C)CC[C@@H]3[C@H](OC(=O)C3=C)[C@@H]12 |t:1|
SMILES: CC1=CC[C@@H](O)[C@]2(C)CC[C@@H]3[C@H](OC(=O)C3=C)[C@@H]12 |t:1|
InChI key: PLSSEPIRACGCBO-PFFFPCNUSA-N
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