SpectraBase Spectrum ID |
J6AsLLPQE6j |
Name |
3-[1'-(4''-Methoxyphenyl)-2',2'-dimethylpropylidene]androsta-1,4-diene-17-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H40O2 |
InChI |
InChI=1S/C31H40O2/c1-29(2,3)28(20-7-10-23(33-6)11-8-20)21-15-17-30(4)22(19-21)9-12-24-25-13-14-27(32)31(25,5)18-16-26(24)30/h7-8,10-11,15,17,19,24-26H,9,12-14,16,18H2,1-6H3/b28-21+/t24-,25-,26-,30-,31-/m0/s1 |
InChIKey |
RVJHHBZTPNDQBV-QXDSORMHSA-N |
Molecular Weight |
444.659 g/mol |
SMILES |
[C@@]12(C(=C\C(C=C2)=C\(C(C)(C)C)c2ccc(cc2)OC)CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)=O)[H])[H])C |
SPLASH |
splash10-000l-0102900000-91a5c84c6ac7e0cbbb08 |
Source of Spectrum |
U-1997-615-3 |
Synonyms |
3-[1-(4-methoxyphenyl)-2,2-dimethylpropylidene]androsta-1,4-dien-17-one |
Wiley ID |
769614 |