SpectraBase Spectrum ID |
2njV49NlB2k |
Name |
16.ALPHA.-(ACETYLOXY)-3-(METHOXYIMINO)-ANDROST-4-EN-17.BETA.-YL ACETATE |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
417.251523226 u |
Formula |
C24H35NO5 |
InChI |
InChI=1S/C24H35NO5/c1-14(26)29-21-13-20-18-7-6-16-12-17(25-28-5)8-10-23(16,3)19(18)9-11-24(20,4)22(21)30-15(2)27/h12,18-22H,6-11,13H2,1-5H3/b25-17+/t18?,19?,20?,21-,22+,23+,24+/m1/s1 |
InChIKey |
MQLUMOPUEPNBIQ-BLFONNBNSA-N |
Molecular Weight |
417.546 g/mol |
Nominal Mass |
417 u |
Number of Peaks |
159 |
SMILES |
C(C)(=O)O[C@]1([C@@](CC2C3CCC4=C\C(CC[C@@]4(C3CC[C@]12C)C)=N\OC)(OC(=O)C)[H])[H] |
SPLASH |
splash10-000i-1494000000-50cfd3e7dd73fcde6fb7 |
Source File Reference |
LMCM-66988-680X |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
(10R,13S,16R,17R,E)-3-(methoxyimino)-10,13-dimethyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-16,17-diyl diacetate |
Wiley ID |
4_2353 |