CHEBI:79651 - 4-Methyl-4-aza-5-pregnene-3,20-dione

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ChEBI Name 4-Methyl-4-aza-5-pregnene-3,20-dione
ChEBI ID CHEBI:79651
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H31NO2
Net Charge 0
Average Mass 329.47630
Monoisotopic Mass 329.23548
InChI InChI=1S/C21H31NO2/c1-13(23)15-6-7-16-14-5-8-18-21(3,12-10-19(24)22(18)4)17(14)9-11-20(15,16)2/h8,14-17H,5-7,9-12H2,1-4H3/t14-,15+,16-,17-,20+,21+/m0/s1
InChIKey HQWPPVLSHLFTDY-HGUQNLGYSA-N
SMILES CN1C(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(C)=O)[C@@H]3CC=C12
ChEBI Ontology
Outgoing 4-Methyl-4-aza-5-pregnene-3,20-dione (CHEBI:79651) is a 20-oxo steroid (CHEBI:36885)
Manual Xref Database
C15133 KEGG COMPOUND
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