Search, Select and Inquire
20 million chemicals online

Reference, SMILES, CAS, Chemical name...

Amb6599799

Duplicate ID
CAS Number 1092699-91-6
Molecule Name 16-(4-nitrobenzylidene)androst-5-ene-3,17-diol
10,13-Dimethyl-16-[1-(4-nitro-phenyl)-meth-(E)-ylidene]-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
SmilesOC1CCC2(C(=CCC3C2CCC2(C3C/C(=C\c3ccc(cc3)[N+](=O)[O-])/C2O)C)C1)C
InchiKeyCHCOIPAZGMXLFP-GHRIWEEISA-N
InChi InChI=1S/C26H33NO4/c1-25-11-9-20(28)15-18(25)5-8-21-22(25)10-12-26(2)23(21)14-17(24(26)29)13-16-3-6-19(7-4-16)27(30)31/h3-7,13,20-24,28-29H,8-12,14-15H2,1-2H3/b17-13+
Formula C26H33NO4
Molecular weight 423.545
Rings 5
logP 5.7959
PSA 86.28
MR 124.755
Get similar structures