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17-ALPHA-[(N-4-AZIDO-2-NITROPHENYL)-AMINOPROPYL]-17-BETA-HYDROXY-5-ALPHA-ANDROSTAN-3-ONE
SpectraBase Compound ID Jhu5XOqjApe
InChI InChI=1S/C28H39N5O4/c1-26-12-8-20(34)16-18(26)4-6-21-22(26)9-13-27(2)23(21)10-14-28(27,35)11-3-15-30-24-7-5-19(31-32-29)17-25(24)33(36)37/h5,7,17-18,21-23,30,35H,3-4,6,8-16H2,1-2H3/t18-,21+,22-,23-,26-,27-,28-/m0/s1
InChIKey HRJUKZOUDDSUQP-DMDZBCNISA-N
Mol Weight 509.7 g/mol
Molecular Formula C28H39N5O4
Exact Mass 509.300205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Wjy0Oiw8yL
Name 17-ALPHA-[(N-4-AZIDO-2-NITROPHENYL)-AMINOPROPYL]-17-BETA-HYDROXY-5-ALPHA-ANDROSTAN-3-ONE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H39N5O4
InChI InChI=1S/C28H39N5O4/c1-26-12-8-20(34)16-18(26)4-6-21-22(26)9-13-27(2)23(21)10-14-28(27,35)11-3-15-30-24-7-5-19(31-32-29)17-25(24)33(36)37/h5,7,17-18,21-23,30,35H,3-4,6,8-16H2,1-2H3/t18-,21+,22-,23-,26-,27-,28-/m0/s1
InChIKey HRJUKZOUDDSUQP-DMDZBCNISA-N
Literature Reference Author E.MAPPUS,C.CHAMBON,B.FENET,M.R.DERAVEL,C.GRENOT,C.Y.CUILLERO N
Literature Reference Citation STEROIDS,65,459(2000)
Molecular Weight 509.649 g/mol
Sample ID 968718
Solvent C5D5N