SpectraBase Spectrum ID |
2wk8o1vtbSv |
Name |
5.ALPHA.-ANDROSTAN-6.BETA.-OL(6.BETA.-ACETATE) |
CAS Registry Number |
35487-68-4 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
318.255880333 u |
Formula |
C21H34O2 |
InChI |
InChI=1S/C21H34O2/c1-14(22)23-19-13-15-16-8-6-10-20(16,2)12-9-17(15)21(3)11-5-4-7-18(19)21/h15-19H,4-13H2,1-3H3/t15-,16-,17-,18+,19+,20-,21+/m0/s1 |
InChIKey |
FSSDJELRFAUPNU-HFYYJUFZSA-N |
Molecular Weight |
318.501 g/mol |
Nominal Mass |
318 u |
Number of Peaks |
73 |
SMILES |
C1CC[C@@]2([C@]3(CC[C@@]4(CCC[C@]4([C@@]3(C[C@]([C@]2(C1)[H])(OC(C)=O)[H])[H])[H])C)[H])C |
SPLASH |
splash10-052f-2490000000-667634d9969c966e9852 |
Source File Reference |
LMCM-33752-611D |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
ANDROSTAN-6-YL ACETATE
(5S,6R,8S,9S,10R,13S,14S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-6-yl acetate |
Wiley ID |
4_2341 |