EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:5955 - Ipomoeamarone

ChEBI IDCHEBI:5955
ChEBI NameIpomoeamarone
Stars
Last Modified10 July 2017
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC(C)CC(=O)C[C@]1(C)CC[C@H](c2ccoc2)O1
InChIInChI=1S/C15H22O3/c1-11(2)8-13(16)9-15(3)6-4-14(18-15)12-5-7-17-10-12/h5,7,10-11,14H,4,6,8-9H2,1-3H3/t14-,15+/m1/s1
InChIKeyWOFDWNOSFDVCDF-CABCVRRESA-N
ChEBI Ontology
Outgoing Relation(s)
Ipomoeamarone (CHEBI:5955) is a oxolanes (CHEBI:26912)
Synonyms  Source
IpomoeamaroneKEGG COMPOUND
(+)-NgaioneKEGG COMPOUND
Manual XrefsDatabases
C09689KEGG COMPOUND
C00003152KNApSAcK
Registry NumbersSources
CAS:494-23-5KEGG COMPOUND