| SpectraBase Spectrum ID |
7x7rnhLyQPb |
| Name |
5.ALPHA.-ANDROSTANE-3.ALPHA.,11.BETA.-DIOL-17-ONE |
| CAS Registry Number |
57-61-4 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
306.219494823 u |
| Formula |
C19H30O3 |
| InChI |
InChI=1S/C19H30O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12+,13-,14-,15-,17+,18-,19-/m0/s1 |
| InChIKey |
PIXFHVWJOVNKQK-PTXZMSDUSA-N |
| Molecular Weight |
306.446 g/mol |
| Nominal Mass |
306 u |
| Number of Peaks |
187 |
| SMILES |
O[C@@]1([C@@]2([C@]3(CC[C@](C[C@@]3(CC[C@]2([C@@]2(CCC([C@]2(C1)C)=O)[H])[H])[H])(O)[H])C)[H])[H] |
| SPLASH |
splash10-0a4l-7951000000-10667eb187e77094fe4a |
| Source File Reference |
LMCM-93942-127F |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
3,11-DIHYDROXYANDROSTAN-17-ONE
(3R,5S,8S,9S,10S,11S,13S,14S)-3,11-dihydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one |
| Wiley ID |
4_2860 |
