SpectraBase Spectrum ID |
77Wsh5Sod9N |
Name |
5.ALPHA.-ANDROST-2-ENE-6.ALPHA.-OL-1-ONE |
CAS Registry Number |
25846-00-8 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
288.208930140 u |
Formula |
C19H28O2 |
InChI |
InChI=1S/C19H28O2/c1-18-9-4-6-13(18)12-11-16(20)15-5-3-7-17(21)19(15,2)14(12)8-10-18/h3,7,12-16,20H,4-6,8-11H2,1-2H3/t12-,13-,14-,15+,16-,18-,19+/m0/s1 |
InChIKey |
NEEQXKDQZDFIKV-SPHXVARUSA-N |
Molecular Weight |
288.431 g/mol |
Nominal Mass |
288 u |
Number of Peaks |
108 |
SMILES |
O[C@@]1([C@]2(CC=CC([C@@]2([C@]2(CC[C@@]3(CCC[C@]3([C@@]2(C1)[H])[H])C)[H])C)=O)[H])[H] |
SPLASH |
splash10-052b-9730000000-877a5d11d2259c0b53b3 |
Source File Reference |
LMCM-83472-899W |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
6-HYDROXYANDROST-2-EN-1-ONE
(5S,6S,8S,9S,10R,13S,14S)-6-hydroxy-10,13-dimethyl-4,5,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-one |
Wiley ID |
4_1040 |