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6-Azaandrostan-7-one, 6-benzyl-17.beta.-hydroxy-
SpectraBase Compound ID C4YYmWcskCY
InChI InChI=1S/C25H35NO2/c1-24-14-7-6-10-20(24)26(16-17-8-4-3-5-9-17)23(28)22-18-11-12-21(27)25(18,2)15-13-19(22)24/h3-5,8-9,18-22,27H,6-7,10-16H2,1-2H3/t18-,19-,20?,21-,22-,24+,25-/m0/s1
InChIKey XXNLNQZUOJCQFN-OXNCCWIZSA-N
Mol Weight 381.6 g/mol
Molecular Formula C25H35NO2
Exact Mass 381.266779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQ2CwV3XLvh
Name 6-Azaandrostan-7-one, 6-benzyl-17.beta.-hydroxy-
CAS Registry Number 16373-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H35NO2
InChI InChI=1S/C25H35NO2/c1-24-14-7-6-10-20(24)26(16-17-8-4-3-5-9-17)23(28)22-18-11-12-21(27)25(18,2)15-13-19(22)24/h3-5,8-9,18-22,27H,6-7,10-16H2,1-2H3/t18-,19-,20?,21-,22-,24+,25-/m0/s1
InChIKey XXNLNQZUOJCQFN-OXNCCWIZSA-N
Molecular Weight 381.560 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@@]3(C(N(C4[C@]([C@]3(CC2)[H])(C)CCCC4)Cc2ccccc2)=O)[H])(CC1)[H])C)[H]
SPLASH splash10-003u-4629000000-272392dfea5c2c6407d1
Source of Spectrum T-67-4606-0
Synonyms (1S,3aS,3bR,9aR,9bS,11aS)-5-benzyl-1-hydroxy-9a,11a-dimethylhexadecahydro-4H-cyclopenta[i]phenanthridin-4-one 17.beta.-hydroxy-N-benzyl-6-aza-5.XI.-androstan-7-one
Wiley ID 1360294