SpectraBase Spectrum ID |
3D5S2XWQHkY |
Name |
4-AZAANDROST-5-EN-3-ONE, 17-[[[4-[BIS(2-CHLOROETHYL)AMINO]PHENYL]ACETYL]OXY]-4-METHYL-, (17beta)- |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C31H42O3N2Cl2 |
InChI |
InChI=1S/C31H42Cl2N2O3/c1-30-15-13-28(36)34(3)26(30)10-8-23-24-9-11-27(31(24,2)14-12-25(23)30)38-29(37)20-21-4-6-22(7-5-21)35(18-16-32)19-17-33/h4-7,10,23-25,27H,8-9,11-20H2,1-3H3 |
InChIKey |
FSWLHBSQHUOOSF-UHFFFAOYSA-N |
Instrument Name |
CH5 |
Molecular Weight |
560.2563 |
SMILES |
C1(=O)N(C)C2=CCC3C4CCC(OC(Cc5ccc(N(CCCl)CCCl)cc5)=O)C4(C)CCC3C2(C)CC1 |
SPLASH |
splash10-03di-3630090000-9ca18cd6d7e9be8c7654 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |