| SpectraBase Spectrum ID |
1Gbadete76d |
| Name |
5.BETA.-ANDROSTANE-3,7,17-TRIONE |
| CAS Registry Number |
29916-20-9 |
| Copyright |
Copyright © 2011-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
302.188194694 u |
| Formula |
C19H26O3 |
| InChI |
InChI=1S/C19H26O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11,13-14,17H,3-10H2,1-2H3/t11-,13-,14-,17-,18-,19-/m0/s1 |
| InChIKey |
FJZKBPUBWKYMHG-HTZOKLMBSA-N |
| Molecular Weight |
302.414 g/mol |
| Nominal Mass |
302 u |
| Number of Peaks |
42 |
| SMILES |
C1(CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(C(C[C@@]2(C1)[H])=O)[H])[H])=O)C)[H])C)=O |
| SPLASH |
splash10-0a4i-5293000000-341cc88387c2e0d08444 |
| Source File Reference |
LMCM-29544-346H |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
ANDROSTANE-3,7,17-TRIONE
(5S,8R,9S,10S,13S,14S)-10,13-dimethyldecahydro-1H-cyclopenta[a]phenanthrene-3,7,17(2H,4H,8H)-trione |
| Wiley ID |
4_1300 |
