| SpectraBase Spectrum ID |
L3illS4fiDQ |
| Name |
16.alpha.-Chloro-3-acetoxy-7-,alpha.-methylestra-1,3,5(10)-triene-17-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25ClO3 |
| InChI |
InChI=1S/C21H25ClO3/c1-11-8-13-9-14(25-12(2)23)4-5-15(13)16-6-7-21(3)17(19(11)16)10-18(22)20(21)24/h4-5,9,11,16-19H,6-8,10H2,1-3H3/t11-,16-,17+,18-,19-,21+/m1/s1 |
| InChIKey |
CWYXYIDWUMOSHA-BUENHFLCSA-N |
| Molecular Weight |
360.881 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3([C@@](Cc4c([C@]3(CC2)[H])ccc(OC(=O)C)c4)(C)[H])[H])(C[C@](C1=O)(Cl)[H])[H])C |
| SPLASH |
splash10-014i-0059000000-13ae0628c2c6cc798103 |
| Source of Spectrum |
E1-36-269-10 |
| Synonyms |
(7alpha,16alpha)-16-chloro-7-methyl-17-oxoestra-1,3,5(10)-trien-3-yl acetate |
| Wiley ID |
1574618 |
