Name: Austinol
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT220773149
Cas No:72040-27-8
常用名:Austinol
IUPAC:(1'R,2'S,3R,8'S,9'S,12'R,13'R)-8',12'-dihydroxy-2,2,2',6',9',13'-hexamethyl-16'-methylidene-2,6-dihydro-10',14'-dioxaspiro[pyran-3,5'-tetracyclo[7.6.1.0^{1,12}.0^{2,7}]hexadecan]-6'-ene-6,11',15'-trione
IUPAC:(1'R,2'S,3R,8'S,9'S,12'R,13'R)-8',12'-dihydroxy-2,2,2',6',9',13'-hexamethyl-16'-methylidene-2,6-dihydro-10',14'-dioxaspiro[pyran-3,5'-tetracyclo[7.6.1.0^{1,12}.0^{2,7}]hexadecan]-6'-ene-6,11',15'-trione
InChI key:InChIKey=DNKFADXVMUNRRM-XOPCMRBUSA-N

分子式:C25H30O8
分子量:458.507
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@H]1OC(=O)[C@]23C(=C)[C@](C)(OC(=O)[C@]12O)[C@@H](O)C1=C(C)[C@@]2(CC[C@]31C)C=CC(=O)OC2(C)C
SMILES:C[C@H]1OC(=O)[C@]23C(=C)[C@](C)(OC(=O)[C@]12O)[C@@H](O)C1=C(C)[C@@]2(CC[C@]31C)C=CC(=O)OC2(C)C

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