(11beta)-11-Hydroxypregna-1,4-diene-3,20-dione (8S,9S,10R,11S,13S,14S,17S)-17-乙酰基-11-羟基-10,13-二甲基-6,7,8,9,10,11,12,13,14,15, 16,17-十二氢-3H-环戊[a]菲-3-酮

CAS 4224-37-7 MFCD04224377

化学结构图

4224-37-7
SMILES: CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3C(O)C[C@]12C

化学属性

Mol. FormulaC21H28O3
Mol. Weight328.45

别名和识别编码

Chemical NamePregna-1,4-diene-11-ol-3,20-dione
Chemicalbook IDCB01339983
InChIKeyXYVVSFGOAQGVRE-ATWVFEABSA-N
PubChem Substance ID3080605
InChIInChI=1S/C21H28O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h8-10,15-19,24H,4-7,11H2,1-3H3/t15-,16+,17-,18-,19+,20-,21+/m0/s1
Synonym (8S,9S,10R,11S,13S,14S,17S)-17-Acetyl-11-hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one {LY} (8S,9S,10R,11S,13S,14S,17S)-17-Acetyl-11-hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one delta-HOP pregna-1,4-diene-11-ol-3,20-dione {} {LY} (8S,9S,10R,11S,13S,14S,17S)-17-Acetyl-11-hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one {} {} {LY} (8S,9S,10R,11S,13S,14S,17S)-17-Acetyl-11-hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one {} {} {} {LY} (8S,9S,10R,11S,13S,14S,17S)-17-Acetyl-11-hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one {} {} {} {} {LY} (8S,9S,10R,11S,13S,14S,17S)-17-Acetyl-11-hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one {} {} {} {} {}
CAS Number4224-37-7
Chemical Name Translation (8S,9S,10R,11S,13S,14S,17S)-17-乙酰基-11-羟基-10,13-二甲基-6,7,8,9,10,11,12,13,14,15, 16,17-十二氢-3H-环戊[a]菲-3-酮
Canonical SMILESC[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@@H]3O)[C@@H](C(C)=O)CC4)[H])(CCC1=CC(=O)C=C2)[H])[H]
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