5α-Pregnane-3,11,20-trione (5S,8S,9S,10S,13S,14S,17S)-17-乙酰基-10,13-二甲基十四氢-3H-环戊[a]菲-3,11(2H)-二酮
CAS 2089-06-7 MFCD00055883
化学结构图
SMILES: CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C
化学属性
| Mol. Formula | C21H30O3 |
|---|---|
| Mol. Weight | 330.46 |
别名和识别编码
| Chemical Name | 5α-Pregnane-3,11,20-trione |
|---|---|
| MDL Number | MFCD00055883 |
| CAS Number | 2089-06-7 |
| Synonym | (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {} {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {} {} {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {} {} {} { {} {} {} {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {} {} {} {} {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {} {} {} {} {} {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione {} {} {} {} {} {} {LY} (5S,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyltetradecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-di |
| PubChem Substance ID | 968899 |
| Chemical Name Translation | (5S,8S,9S,10S,13S,14S,17S)-17-乙酰基-10,13-二甲基十四氢-3H-环戊[a]菲-3,11(2H)-二酮 |
| InChI | InChI=1S/C21H30O3/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/h13,15-17,19H,4-11H2,1-3H3/t13-,15-,16+,17-,19+,20-,21+/m0/s1 |
| Canonical SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C |
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