EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:80097 - 5-Dehydroavenasterol

ChEBI IDCHEBI:80097
ChEBI Name5-Dehydroavenasterol
Stars
Last Modified27 January 2016
DownloadsMolfile
FormulaC29H46O
Net Charge0
Average Mass410.686
Monoisotopic Mass410.35487
SMILESC/C=C(/CC[C@@H](C)C1CCC2C3=CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C)C(C)C
InChIInChI=1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10-11,19-20,23,25-27,30H,8-9,12-18H2,1-6H3/b21-7-/t20-,23+,25?,26?,27?,28+,29-/m1/s1
InChIKeyXPRWWANUPMYKMF-UUHDPGOWSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
ChEBI Ontology
Outgoing Relation(s)
5-Dehydroavenasterol (CHEBI:80097) has parent hydride stigmastane (CHEBI:26773)
5-Dehydroavenasterol (CHEBI:80097) is a steroid (CHEBI:35341)
Manual XrefsDatabases
C15783KEGG COMPOUND
C00007527KNApSAcK
HMDB0006852HMDB