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17A-Benzyl-3.beta.-acetoxy-17A-aza-D-homoandrost-5-ene-17-one

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17A-Benzyl-3.beta.-acetoxy-17A-aza-D-homoandrost-5-ene-17-one
SpectraBase Compound ID BcOMTuYz0yP
InChI InChI=1S/C28H37NO3/c1-19(30)32-22-13-15-27(2)21(17-22)9-10-23-24(27)14-16-28(3)25(23)11-12-26(31)29(28)18-20-7-5-4-6-8-20/h4-9,22-25H,10-18H2,1-3H3
InChIKey RAAXNGOUKXZCGE-UHFFFAOYSA-N
Mol Weight 435.6 g/mol
Molecular Formula C28H37NO3
Exact Mass 435.277344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1Tv088u8Xc
Name 17A-Benzyl-3.beta.-acetoxy-17A-aza-D-homoandrost-5-ene-17-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.277344052 u
Formula C28H37NO3
InChI InChI=1S/C28H37NO3/c1-19(30)32-22-13-15-27(2)21(17-22)9-10-23-24(27)14-16-28(3)25(23)11-12-26(31)29(28)18-20-7-5-4-6-8-20/h4-9,22-25H,10-18H2,1-3H3
InChIKey RAAXNGOUKXZCGE-UHFFFAOYSA-N
Molecular Weight 435.608 g/mol
SMILES C1(CCC2(C(C1)=CCC1C2CCC2(C1CCC(N2CC1=CC=CC=C1)=O)C)C)OC(C)=O