CHEBI:34930 - Pregnenolone acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Pregnenolone acetate
ChEBI ID CHEBI:34930
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H34O3
Net Charge 0
Average Mass 358.515
Monoisotopic Mass 358.25079
InChI InChI=1S/C23H34O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,17-21H,6-13H2,1-4H3/t17-,18-,19+,20-,21-,22-,23+/m0/s1
InChIKey CRRKVZVYZQXICQ-RJJCNJEVSA-N
SMILES CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(C)=O)[C@@H]3CC=C2C1
ChEBI Ontology
Outgoing Pregnenolone acetate (CHEBI:34930) is a steroid ester (CHEBI:47880)
Synonyms Sources
3beta-Hydroxypregn-5-en-20-one acetate KEGG COMPOUND
Pregnenolone acetate KEGG COMPOUND
Manual Xref Database
C14658 KEGG COMPOUND
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Registry Number Type Source
1778-02-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014