| SpectraBase Spectrum ID |
3WjpetDdSvh |
| Name |
5.ALPHA.-ANDROSTANE-1.BETA.,3.BETA.-DIOL-17-ONE |
| CAS Registry Number |
20998-17-8 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
306.219494823 u |
| Formula |
C19H30O3 |
| InChI |
InChI=1S/C19H30O3/c1-18-8-7-15-13(14(18)5-6-16(18)21)4-3-11-9-12(20)10-17(22)19(11,15)2/h11-15,17,20,22H,3-10H2,1-2H3/t11-,12+,13-,14-,15-,17+,18-,19-/m0/s1 |
| InChIKey |
PLRVEARMBLHHAS-PTXZMSDUSA-N |
| Molecular Weight |
306.446 g/mol |
| Nominal Mass |
306 u |
| Number of Peaks |
155 |
| SMILES |
O[C@@]1(C[C@@](C[C@@]2(CC[C@]3([C@@]4(CCC([C@]4(CC[C@@]3([C@@]12C)[H])C)=O)[H])[H])[H])(O)[H])[H] |
| SPLASH |
splash10-0apu-6961000000-60477c83516664bf9e86 |
| Source File Reference |
LMCM-88258-118V |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
1,3-DIHYDROXYANDROSTAN-17-ONE
(1R,3R,5S,8R,9S,10S,13S,14S)-1,3-dihydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one |
| Wiley ID |
4_2943 |
