CHEBI:34531 - Alphaxolone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Alphaxolone
ChEBI ID CHEBI:34531
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C21H32O3
C21H32O3
Net Charge 0
Average Mass 332.478
Monoisotopic Mass 332.23514
InChI InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17-,19+,20-,21+/m0/s1
InChIKey DUHUCHOQIDJXAT-OLVMNOGESA-N
SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C
Roles Classification
Biological Role(s): hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Alphaxolone (CHEBI:34531) is a corticosteroid hormone (CHEBI:36699)
Synonyms Sources
alfadione DrugCentral
Alfaxalone KEGG COMPOUND
alfaxolone DrugCentral
alphaxalone DrugCentral
Alphaxolone KEGG COMPOUND
Manual Xrefs Databases
133 DrugCentral
1759 VSDB
C13803 KEGG COMPOUND
LSM-2922 LINCS
View more database links
Registry Number Type Source
23930-19-0 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017