| SpectraBase Spectrum ID |
2xm5I1zARc |
| Name |
5.ALPHA.-ANDROSTANE-11.ALPHA.,16.ALPHA.-DIOL-3-ONE |
| CAS Registry Number |
49643-92-7 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
306.219494823 u |
| Formula |
C19H30O3 |
| InChI |
InChI=1S/C19H30O3/c1-18-9-13(21)8-15(18)14-4-3-11-7-12(20)5-6-19(11,2)17(14)16(22)10-18/h11,13-17,21-22H,3-10H2,1-2H3/t11-,13+,14-,15-,16+,17+,18-,19-/m0/s1 |
| InChIKey |
AECDEEAQXMHYHE-AAWIKGOXSA-N |
| Molecular Weight |
306.446 g/mol |
| Nominal Mass |
306 u |
| Number of Peaks |
98 |
| SMILES |
O[C@]1(C[C@]2(C[C@]([C@@]3([C@]4(CCC(C[C@@]4(CC[C@]3([C@@]2(C1)[H])[H])[H])=O)C)[H])(O)[H])C)[H] |
| SPLASH |
splash10-05vp-9730000000-49ef41f4bd76609e3d24 |
| Source File Reference |
LMCM-50484-738U |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
11,16-DIHYDROXYANDROSTAN-3-ONE
(5S,8S,9S,10S,11R,13S,14S,16R)-11,16-dihydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
| Wiley ID |
4_2576 |
