EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:69040 - Seselin

ChEBI IDCHEBI:69040
ChEBI NameSeselin
Stars
DefinitionA natural product found in Citropsis articulata.
Secondary ChEBI IDCHEBI:9129
Last Modified22 September 2014
DownloadsMolfile
FormulaC14H12O3
Net Charge0
Average Mass228.247
Monoisotopic Mass228.07864
SMILESCC1(C)C=Cc2c(ccc3ccc(=O)oc23)O1
InChIInChI=1S/C14H12O3/c1-14(2)8-7-10-11(17-14)5-3-9-4-6-12(15)16-13(9)10/h3-8H,1-2H3
InChIKeyQUVCQYQEIOLHFZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Citropsis articulata (IPNI:771824-1) root (BTO:0001188) PubMed (21985060) Previous component: root bark; Cyclohexane and ethyl acetate extract of dried, powdered root bark.
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Seselin (CHEBI:69040) has role metabolite (CHEBI:25212)
Seselin (CHEBI:69040) is a coumarins (CHEBI:23403)
Synonyms  Source
SeselinKEGG COMPOUND
AmyrolinChEBI
8,8-dimethyl-2H,8H-pyrano[2,3-f]chromen-2-oneChEBI
Manual XrefsDatabases
C09312KEGG COMPOUND
C00000300KNApSAcK
HMDB0034257HMDB
Registry NumbersSources
CAS:523-59-1KEGG COMPOUND
CAS:523-59-1ChemIDplus
Citations