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3-.beta.-Hydroxy-6-azaandrosta-4-ene-7,17-dione
SpectraBase Compound ID A3EaNhP18HA
InChI InChI=1S/C18H25NO3/c1-17-7-5-10(20)9-13(17)19-16(22)15-11-3-4-14(21)18(11,2)8-6-12(15)17/h9-12,15,20H,3-8H2,1-2H3,(H,19,22)/t10-,11-,12-,15-,17+,18-/m0/s1
InChIKey ANKDQCKQXUZBJO-HGOSIMBFSA-N
Mol Weight 303.4 g/mol
Molecular Formula C18H25NO3
Exact Mass 303.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rFP9YRBIyk
Name 3-.beta.-Hydroxy-6-azaandrosta-4-ene-7,17-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO3
InChI InChI=1S/C18H25NO3/c1-17-7-5-10(20)9-13(17)19-16(22)15-11-3-4-14(21)18(11,2)8-6-12(15)17/h9-12,15,20H,3-8H2,1-2H3,(H,19,22)/t10-,11-,12-,15-,17+,18-/m0/s1
InChIKey ANKDQCKQXUZBJO-HGOSIMBFSA-N
Molecular Weight 303.402 g/mol
SMILES N1C2=C[C@](CC[C@@]2([C@]2(CC[C@]3([C@]([C@@]2(C1=O)[H])(CCC3=O)[H])C)[H])C)(O)[H]
SPLASH splash10-001r-6090000000-2c387fcf172d1a88669d
Source of Spectrum H1-38-1057-9
Synonyms (3aS,3bR,7S,9aR,9bS,11aS)-7-hydroxy-9a,11a-dimethyl-2,3,3a,5,7,8,9,9a,9b,10,11,11a-dodecahydro-1H-cyclopenta[i]phenanthridine-1,4(3bH)-dione
Wiley ID 756264