| SpectraBase Spectrum ID |
2VqceDQCqHR |
| Name |
5.BETA.-ANDROSTAN-3.BETA.-OL-17-ONE-17-(O-METHYLOXIME) |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
319.251129305 u |
| Formula |
C20H33NO2 |
| InChI |
InChI=1S/C20H33NO2/c1-19-10-8-14(22)12-13(19)4-5-15-16-6-7-18(21-23-3)20(16,2)11-9-17(15)19/h13-17,22H,4-12H2,1-3H3/b21-18+/t13-,14+,15+,16+,17+,19+,20+/m1/s1 |
| InChIKey |
MQRMZRCCQGCVFQ-PUUZKDINSA-N |
| Molecular Weight |
319.489 g/mol |
| Nominal Mass |
319 u |
| Number of Peaks |
122 |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@@]4(\C(CC[C@]4([C@@]3(CC[C@@]2(C1)[H])[H])[H])=N\OC)C)[H])C)[H] |
| SPLASH |
splash10-000i-5490000000-b2cde242fd27e99963ac |
| Source File Reference |
LMCM-12208-972U |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
3.BETA.-HYDROXY-5.BETA.-ANDROSTAN-17-ONE O-METHYLOXIME
3-HYDROXYANDROSTAN-17-ONE O-METHYLOXIME
(3aS,3bR,5aR,7S,9aS,9bS,11aS,E)-3-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one O-methyl oxime |
| Wiley ID |
4_1081 |
