CHEBI:79523 - 17beta-(Benzoyloxy)-B-norandrost-4-en-3-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 17beta-(Benzoyloxy)-B-norandrost-4-en-3-one
ChEBI ID CHEBI:79523
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H30O3
Net Charge 0
Average Mass 378.50390
Monoisotopic Mass 378.21949
InChI InChI=1S/C25H30O3/c1-24-12-10-18(26)14-17(24)15-19-20-8-9-22(25(20,2)13-11-21(19)24)28-23(27)16-6-4-3-5-7-16/h3-7,14,19-22H,8-13,15H2,1-2H3/t19-,20-,21-,22-,24-,25-/m0/s1
InChIKey CMGONSOWZSKMAU-BKWLFHPQSA-N
SMILES C[C@]12CC[C@H]3[C@@H](CC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)c1ccccc1
ChEBI Ontology
Outgoing 17beta-(Benzoyloxy)-B-norandrost-4-en-3-one (CHEBI:79523) is a benzoate ester (CHEBI:36054)
Manual Xref Database
C15000 KEGG COMPOUND
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