| SpectraBase Spectrum ID |
IKh1R5IO53D |
| Name |
ANDROST-5-ENE-3.BETA.-OL-17-ONE(3.BETA.-ACETATE) |
| CAS Registry Number |
853-23-6 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
330.219494823 u |
| Formula |
C21H30O3 |
| InChI |
InChI=1S/C21H30O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-18H,5-12H2,1-3H3/t15-,16-,17-,18-,20-,21-/m0/s1 |
| InChIKey |
NCMZQTLCXHGLOK-ZKHIMWLXSA-N |
| Molecular Weight |
330.468 g/mol |
| Nominal Mass |
330 u |
| Number of Peaks |
96 |
| SMILES |
[C@]1(CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CC=C2C1)[H])[H])=O)C)[H])C)(OC(C)=O)[H] |
| SPLASH |
splash10-00di-2490000000-db5d64cd308312151a4b |
| Source File Reference |
LMCM-39454-231E |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
17-OXOANDROST-5-EN-3-YL ACETATE
(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate |
| Wiley ID |
4_1044 |
