Name: Biatractylolide
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317351
Cas No:182426-37-5
常用名:Biatractylolide
别名:双白术内酯, (+)-Biatractylolide
IUPAC:(4aR,8aS)-9a-[(4aR,8aS,9aR)-3,8a-dimethyl-5-methylidene-2-oxo-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-9a-yl]-3,8a-dimethyl-5-methylidene-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
IUPAC:(4aR,8aS)-9a-[(4aR,8aS,9aR)-3,8a-dimethyl-5-methylidene-2-oxo-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-9a-yl]-3,8a-dimethyl-5-methylidene-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
InChI key:RBJDJJGMGHKQMI-LYKWRDEMSA-N

分子式:C30H38O4
分子量:462.63
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12CC3=C(C)C(=O)OC3(C[C@]1(C)CCCC2=C)[C@@]12C[C@]3(C)CCCC(=C)[C@@]3([H])CC1=C(C)C(=O)O2 |c:3,t:35|
SMILES:[H][C@]12CC3=C(C)C(=O)OC3(C[C@]1(C)CCCC2=C)[C@@]12C[C@]3(C)CCCC(=C)[C@@]3([H])CC1=C(C)C(=O)O2 |c:3,t:35|

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