SpectraBase Spectrum ID |
GWtiqwO2uDL |
Name |
ANDROST-4-ENE-2.ALPHA.-OL-3,17-DIONE |
CAS Registry Number |
571-17-5 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
302.188194694 u |
Formula |
C19H26O3 |
InChI |
InChI=1S/C19H26O3/c1-18-8-7-14-12(13(18)5-6-17(18)22)4-3-11-9-15(20)16(21)10-19(11,14)2/h9,12-14,16,21H,3-8,10H2,1-2H3/t12-,13-,14-,16+,18-,19-/m0/s1 |
InChIKey |
TUUUEQXMRRIGLT-ZEHJPDPISA-N |
Molecular Weight |
302.414 g/mol |
Nominal Mass |
302 u |
Number of Peaks |
63 |
SMILES |
O[C@]1(C(C=C2CC[C@]3([C@@]4(CCC([C@@]4(C)CC[C@@]3([C@]2(C1)C)[H])=O)[H])[H])=O)[H] |
SPLASH |
splash10-0a4i-9781000000-63bf396ee886c1948438 |
Source File Reference |
LMCM-65252-438T |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
2-HYDROXYANDROST-4-ENE-3,17-DIONE
(2R,8R,9S,10R,13S,14S)-2-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_696 |