CHEBI:79921 - 5alpha-Pregn-2-en-20-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5alpha-Pregn-2-en-20-one
ChEBI ID CHEBI:79921
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H32O
Net Charge 0
Average Mass 300.47820
Monoisotopic Mass 300.24532
InChI InChI=1S/C21H32O/c1-14(22)17-9-10-18-16-8-7-15-6-4-5-12-20(15,2)19(16)11-13-21(17,18)3/h4-5,15-19H,6-13H2,1-3H3/t15-,16+,17-,18+,19+,20+,21-/m1/s1
InChIKey PERPPAKFLWZECF-QYYVTAPASA-N
SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC=CC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing 5alpha-Pregn-2-en-20-one (CHEBI:79921) has parent hydride pregnane (CHEBI:8386)
5alpha-Pregn-2-en-20-one (CHEBI:79921) is a steroid (CHEBI:35341)
Manual Xref Database
C15420 KEGG COMPOUND
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