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17.beta.-[(N-Amyl)benzamido]-4-methyl-4-aza-5.alpha.-androstan-3-one
SpectraBase Compound ID PGDi18UfBk
InChI InChI=1S/C31H46N2O2/c1-5-6-7-10-21-11-8-9-12-22(21)29(35)32-26-15-14-24-23-13-16-27-31(3,20-18-28(34)33(27)4)25(23)17-19-30(24,26)2/h8-9,11-12,23-27H,5-7,10,13-20H2,1-4H3,(H,32,35)/t23-,24-,25-,26-,27+,30-,31+/m0/s1
InChIKey XRCYOISYDLRAIJ-NCNDKFIDSA-N
Mol Weight 478.7 g/mol
Molecular Formula C31H46N2O2
Exact Mass 478.355929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ir7VZ3DLXz
Name 17.beta.-[(N-Amyl)benzamido]-4-methyl-4-aza-5.alpha.-androstan-3-one
Alternate Name(s) N-[(4aR,4bS,6aS,7S,9aS,9bS,11aR)-1,4a,6a-trimethyl-2-oxohexadecahydro-1H-indeno[5,4-f]quinolin-7-yl]-2-pentylbenzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H46N2O2
InChI InChI=1S/C31H46N2O2/c1-5-6-7-10-21-11-8-9-12-22(21)29(35)32-26-15-14-24-23-13-16-27-31(3,20-18-28(34)33(27)4)25(23)17-19-30(24,26)2/h8-9,11-12,23-27H,5-7,10,13-20H2,1-4H3,(H,32,35)/t23-,24-,25-,26-,27+,30-,31+/m0/s1
InChIKey XRCYOISYDLRAIJ-NCNDKFIDSA-N
Molecular Weight 478.721 g/mol
SMILES N([C@]1(CC[C@]2([C@@]3(CC[C@]4(N(C(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)C)[H])[H])[H])[H])C(c1c(cccc1)CCCCC)=O
SPLASH splash10-0h90-9830000000-8fa9c0622c481552374b
Source of Spectrum E1-38-1170-47
Wiley ID 1598268