| SpectraBase Spectrum ID |
LowWH6g7iGr |
| Name |
Pregna-5,17(20)-dien-16-one, 3-(acetyloxy)-21-chloro-20-methyl-, (3.beta.,17Z)- |
| Alternate Name(s) |
(1S,2R,5S,10R,11S,14Z,15S)-14-(1-chloropropan-2-ylidene)-2,15-dimethyl-13-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-yl acetate
(20R)-3.beta.-acetoxy-20-hydroxy-16-(1-chloromethylethylene)-5,10-choladiene |
| CAS Registry Number |
115320-74-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H33ClO3 |
| InChI |
InChI=1S/C24H33ClO3/c1-14(13-25)22-21(27)12-20-18-6-5-16-11-17(28-15(2)26)7-9-23(16,3)19(18)8-10-24(20,22)4/h5,17-20H,6-13H2,1-4H3/b22-14+/t17-,18+,19-,20-,23-,24-/m0/s1 |
| InChIKey |
IPYXVHXZYLZMDU-DUCAJYBISA-N |
| Molecular Weight |
404.978 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])(CC(\C1=C\(CCl)C)=O)[H])C |
| SPLASH |
splash10-004i-0229000000-3896463337489baeaf36 |
| Source of Spectrum |
J-53-3472-8 |
| Wiley ID |
1371420 |
