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CHEBI:182989 - 2-(1,2-dihydroxyethyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4-hydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid

ChEBI IDCHEBI:182989
ChEBI Name2-(1,2-dihydroxyethyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4-hydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O10
Net Charge0
Average Mass382.321
Monoisotopic Mass382.09000
SMILESO=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=C(C(=O)O)OC1C(O)CO
InChIInChI=1S/C17H18O10/c18-7-12(22)16-15(11(21)6-13(26-16)17(24)25)27-14(23)4-2-8-1-3-9(19)10(20)5-8/h1-6,11-12,15-16,18-22H,7H2,(H,24,25)/b4-2+
InChIKeyLYTOSEBVFHNSFK-DUXPYHPUSA-N
Species of MetaboliteComponentSourceComments
Cucumis melo (ncbitaxon:3656) seed (BTO:0001226) MetaboLights (MTBLS2993)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-(1,2-dihydroxyethyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4-hydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid (CHEBI:182989) is a hydroxycinnamic acid (CHEBI:24689)
IUPAC Name 
2-(1,2-dihydroxyethyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4-hydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid