SpectraBase Spectrum ID |
FjcEBZjLP6G |
Name |
ANDROST-4-ENE-15.ALPHA.-OL-3,17-DIONE |
CAS Registry Number |
566-08-5 |
Copyright |
Copyright © 2011-2024 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)3-4-13-14(18)6-8-19(2)16(22)10-15(21)17(13)19/h9,13-15,17,21H,3-8,10H2,1-2H3/t13-,14+,15+,17-,18+,19-/m1/s1 |
InChIKey |
MYKMKUGZFQKMOZ-CKDIOHLVSA-N |
Molecular Weight |
302.414 g/mol |
Nominal Mass |
302 u |
Number of Peaks |
98 |
SMILES |
O[C@@]1([C@]2([C@@]3(CCC4=CC(CC[C@@]4([C@]3(CC[C@@]2(C(C1)=O)C)[H])C)=O)[H])[H])[H] |
SPLASH |
splash10-0m90-7921000000-519272efbea2f9d41bdc |
Source File Reference |
LMCM-14998-101M |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
15-HYDROXYANDROST-4-ENE-3,17-DIONE
(8R,9S,10R,13S,14S,15S)-15-hydroxy-10,13-dimethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione |
Wiley ID |
4_618 |