SpectraBase Spectrum ID |
3Mi1ncDrlUl |
Name |
20-[(4'-Hydroxy-3'-phenyl-2',3'-dihydrothiazol-2'-yl)-hydrazono]pregn-4-ene-3-one |
Alternate Name(s) |
(8S,9S,10R,13S,14S,17S)-17-((Z)-1-(2-(4-hydroxy-3-phenyl-2,3-dihydrothiazol-2-yl)hydrazono)ethyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H39N3O2S |
InChI |
InChI=1S/C30H39N3O2S/c1-19(31-32-28-33(27(35)18-36-28)21-7-5-4-6-8-21)24-11-12-25-23-10-9-20-17-22(34)13-15-29(20,2)26(23)14-16-30(24,25)3/h4-8,17-18,23-26,28,32,35H,9-16H2,1-3H3/b31-19-/t23-,24+,25-,26-,28?,29-,30+/m0/s1 |
InChIKey |
GKKHMEBTSOALGO-LJMYMNLVSA-N |
Literature Reference DOI |
10.1002/ardp.201000366 |
Molecular Weight |
505.721 g/mol |
SMILES |
N(\N=C/([C@]1(CC[C@@]2([H])[C@@]3(CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[H])[H])C)C1N(C(=CS1)O)c1ccccc1 |
SPLASH |
splash10-004i-5009450000-0e0ce2ec273db4c46ccb |
Source of Spectrum |
APC-344-601-8 |
Wiley ID |
1769267 |