| SpectraBase Spectrum ID |
1u4J3wsccWF |
| Name |
ANDROSTA-1,4-DIENE-17.BETA.-OL-3,11-DIONE-17.BETA.-ACETATE |
| CAS Registry Number |
5885-10-9 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
342.183109313 u |
| Formula |
C21H26O4 |
| InChI |
InChI=1S/C21H26O4/c1-12(22)25-18-7-6-16-15-5-4-13-10-14(23)8-9-20(13,2)19(15)17(24)11-21(16,18)3/h8-10,15-16,18-19H,4-7,11H2,1-3H3/t15-,16-,18-,19+,20-,21-/m0/s1 |
| InChIKey |
KNKMRDRMDGUBPC-YUWMHKDHSA-N |
| Molecular Weight |
342.435 g/mol |
| Nominal Mass |
342 u |
| Number of Peaks |
134 |
| SMILES |
C1(C=C[C@@]2([C@]3(C(C[C@@]4([C@](CC[C@]4([C@@]3(CCC2=C1)[H])[H])(OC(C)=O)[H])C)=O)[H])C)=O |
| SPLASH |
splash10-01w3-5891000000-cac4d85d8827565f11e6 |
| Source File Reference |
LMCM-89993-871B |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
3,11-DIOXOANDROSTA-1,4-DIEN-17-YL ACETATE
(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3,11-dioxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl acetate |
| Wiley ID |
4_2963 |
