Isoprogesterone (8S,9S,10R,13S,14S,17R)-17-乙酰基-10,13-二甲基-6,7,8,9,10,11,12,13,14,15,16,17-十二氢-1H-环戊烷[a]菲-3(2H)-酮 （孕酮杂质）

CAS 2000-66-0 MFCD02000660

化学结构图

2000-66-0
SMILES: CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C

化学属性

Mol. Weight314.46
Mol. FormulaC21H30O2
Density
Boiling Point447.2±45.0 °C at 760 mmHg
Melting Point145 °C

别名和识别编码

Chemical NameIsoprogesterone
Chemicalbook IDCB02192671
Chemical Name Translation(8S,9S,10R,13S,14S,17R)-17-乙酰基-10,13-二甲基-6,7,8,9,10,11,12,13,14,15,16,17-十二氢-1H-环戊烷[a]菲-3(2H)-酮 （孕酮杂质）
PubChem Substance ID1201516
InChIInChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17-,18-,19-,20-,21+/m0/s1
MDL Number
CAS Number2000-66-0
Synonym (8S,9S,10R,13S,14S,17R)-17-Acetyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Progesterone Impurity) {LY} (8S,9S,10R,13S,14S,17R)-17-Acetyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Progesterone Impurity) {} {LY} (8S,9S,10R,13S,14S,17R)-17-Acetyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Progesterone Impurity) {} {} {LY} (8S,9S,10R,13S,14S,17R)-17-Acetyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Progesterone Impurity) {} {} {} {LY} (8S,9S,10R,13S,14S,17R)-17-Acetyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Progesterone Impurity) {} {} {} {} {} {} {} {} {LY} (8S,9S,10R,13S,14S,17R)-17-Acetyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Progesterone
EC Number
Beilstein Registry Number
Canonical SMILESC[C@@]12[C@]3([H])[C@](CCC1=CC(CC2)=O)([H])[C@@]4([H])[C@](CC3)([C@@H](CC4)C(C)=O)C
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