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CHEBI:180719 - 2-{9-hydroxy-2-oxo-2H,8H,9H-furo[2,3-h]chromen-8-yl}propan-2-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate

ChEBI IDCHEBI:180719
ChEBI Name2-{9-hydroxy-2-oxo-2H,8H,9H-furo[2,3-h]chromen-8-yl}propan-2-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H20O7
Net Charge0
Average Mass408.406
Monoisotopic Mass408.12090
SMILESCC(C)(OC(=O)/C=C/c1ccc(O)cc1)C1Oc2ccc3ccc(=O)oc3c2C1O
InChIInChI=1S/C23H20O7/c1-23(2,30-18(26)11-5-13-3-8-15(24)9-4-13)22-20(27)19-16(28-22)10-6-14-7-12-17(25)29-21(14)19/h3-12,20,22,24,27H,1-2H3/b11-5+
InChIKeyZPQFAJMRRVVETM-VZUCSPMQSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) Article
ChEBI Ontology
Outgoing Relation(s)
2-{9-hydroxy-2-oxo-2H,8H,9H-furo[2,3-h]chromen-8-yl}propan-2-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate (CHEBI:180719) is a furanocoumarin (CHEBI:24128)
IUPAC Name 
2-(9-hydroxy-2-oxo-8,9-dihydrouro[2,3-h]chromen-8-yl)propan-2-yl (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
HMDB0128937HMDB
74852383ChemSpider