EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:175485 - Mammea E/BA

ChEBI IDCHEBI:175485
ChEBI NameMammea E/BA
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H30O7
Net Charge0
Average Mass430.497
Monoisotopic Mass430.19915
SMILESCCC(OC(C)=O)c1cc(=O)oc2c(C(=O)CC(C)C)c(O)c(CC=C(C)C)c(O)c12
InChIInChI=1S/C24H30O7/c1-7-18(30-14(6)25)16-11-19(27)31-24-20(16)22(28)15(9-8-12(2)3)23(29)21(24)17(26)10-13(4)5/h8,11,13,18,28-29H,7,9-10H2,1-6H3
InChIKeyYOWZJSSQEMLPTC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Mammea E/BA (CHEBI:175485) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
1-[5,7-dihydroxy-8-(3-methylbutanoyl)-6-(3-methylbut-2-enyl)-2-oxochromen-4-yl]propyl acetate
Manual XrefsDatabases
9692380ChemSpider
HMDB0030815HMDB