EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:172503 - Celerin

ChEBI IDCHEBI:172503
ChEBI NameCelerin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O4
Net Charge0
Average Mass260.289
Monoisotopic Mass260.10486
SMILESC=CC(C)(C)c1cc(OC)c(O)c2oc(=O)ccc12
InChIInChI=1S/C15H16O4/c1-5-15(2,3)10-8-11(18-4)13(17)14-9(10)6-7-12(16)19-14/h5-8,17H,1H2,2-4H3
InChIKeyKATNIMBVOAPAGX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Celerin (CHEBI:172503) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
8-hydroxy-7-methoxy-5-(2-methylbut-3-en-2-yl)chromen-2-one
Manual XrefsDatabases
HMDB0030110HMDB
137753ChemSpider
Registry NumbersSources
CAS:73815-20-0ChemIDplus