CHEBI:89421 - 3,4-DHPEA-EA

ChEBI IDCHEBI:89421
ChEBI Name3,4-DHPEA-EA
Stars
DownloadsMolfile
FormulaC19H22O8
Net Charge0
Average Mass378.377
Monoisotopic Mass378.13147
SMILESC/C=C1\[C@H](O)OC=C(C(=O)OC)[C@H]1CC(=O)OCCc1ccc(O)c(O)c1
InChIInChI=1S/C19H22O8/c1-3-12-13(14(18(23)25-2)10-27-19(12)24)9-17(22)26-7-6-11-4-5-15(20)16(21)8-11/h3-5,8,10,13,19-21,24H,6-7,9H2,1-2H3/b12-3-/t13-,19+/m0/s1
InChIKeyBIWKXNFEOZXNLX-SQOYHTLWSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
3,4-DHPEA-EA (CHEBI:89421) is a alcohol (CHEBI:30879)
3,4-DHPEA-EA (CHEBI:89421) is a phenols (CHEBI:33853)
Synonyms  Source
3,4-DHPEA-Elenolic acid mono-aldehydeHMDB
methyl (2R,3Z,4S)-4-{2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl}-3-ethylidene-2-hydroxy-3,4-dihydro-2H-pyran-5-carboxylateHMDB
Oleuropein-aglycone mono-aldehydeHMDB
Manual XrefsDatabases
HMDB0029304HMDB
Citations