SpectraBase Spectrum ID |
5iYrXKobysx |
Name |
5.ALPHA.-ANDROSTAN-17.ALPHA.-OL-3-ONE(3-O-METHYLOXIME) |
Copyright |
Copyright © 2011-2025 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
319.251129305 u |
Formula |
C20H33NO2 |
InChI |
InChI=1S/C20H33NO2/c1-19-10-8-14(21-23-3)12-13(19)4-5-15-16-6-7-18(22)20(16,2)11-9-17(15)19/h13,15-18,22H,4-12H2,1-3H3/b21-14+/t13-,15-,16-,17-,18+,19-,20-/m0/s1 |
InChIKey |
ZLRNBJQKNLHALG-GJGICGCDSA-N |
Molecular Weight |
319.489 g/mol |
Nominal Mass |
319 u |
Number of Peaks |
109 |
SMILES |
O[C@@]1(CC[C@]2([C@@]3(CC[C@]4(C\C(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=N\OC)[H])[H])[H])[H] |
SPLASH |
splash10-0170-9774000000-dab7db17736733f16ead |
Source File Reference |
LMCM-39587-320R |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
17-HYDROXYANDROSTAN-3-ONE O-METHYLOXIME
(1R,3aS,3bR,5aS,9aS,9bS,11aS,E)-17-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one O-methyl oxime |
Wiley ID |
4_1109 |