| SpectraBase Spectrum ID |
3exjmfCwVhi |
| Name |
5.ALPHA.-ANDROSTANE-2.BETA.,3.BETA.-DIOL-6-ONE |
| CAS Registry Number |
31427-18-6 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
306.219494823 u |
| Formula |
C19H30O3 |
| InChI |
InChI=1S/C19H30O3/c1-18-6-3-4-12(18)11-8-15(20)14-9-16(21)17(22)10-19(14,2)13(11)5-7-18/h11-14,16-17,21-22H,3-10H2,1-2H3/t11-,12-,13-,14+,16+,17-,18-,19+/m0/s1 |
| InChIKey |
FXXKCLYFCWEQSD-ZDTWFVCMSA-N |
| Molecular Weight |
306.446 g/mol |
| Nominal Mass |
306 u |
| Number of Peaks |
34 |
| SMILES |
O[C@@]1([C@@](C[C@@]2(C(C[C@]3([C@@]4(CCC[C@]4(CC[C@@]3([C@]2(C1)C)[H])C)[H])[H])=O)[H])(O)[H])[H] |
| SPLASH |
splash10-03di-3191000000-c856e4e5a198b750e034 |
| Source File Reference |
LMCM-61492-020Y |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
2,3-DIHYDROXYANDROSTAN-6-ONE
(2S,3R,5S,8S,9S,10R,13S,14S)-2,3-dihydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-6(10H)-one |
| Wiley ID |
4_1762 |
