CHEBI:168642 - 3-(3,4-dihydroxyphenyl)-1-(2,3,4,5,6-pentahydroxyphenyl)prop-2-en-1-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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ChEBI Name 3-(3,4-dihydroxyphenyl)-1-(2,3,4,5,6-pentahydroxyphenyl)prop-2-en-1-one
ChEBI ID CHEBI:168642
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H12O8
Net Charge 0
Average Mass 320.253
Monoisotopic Mass 320.05322
InChI InChI=1S/C15H12O8/c16-7-3-1-6(5-9(7)18)2-4-8(17)10-11(19)13(21)15(23)14(22)12(10)20/h1-5,16,18-23H/b4-2+
InChIKey MZUOSVZPIKKUGD-DUXPYHPUSA-N
SMILES OC1=C(C(O)=C(O)C(O)=C1O)C(=O)/C=C/C2=CC(O)=C(O)C=C2
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing 3-(3,4-dihydroxyphenyl)-1-(2,3,4,5,6-pentahydroxyphenyl)prop-2-en-1-one (CHEBI:168642) is a chalcones (CHEBI:23086)
IUPAC Name
(E)-3-(3,4-dihydroxyphenyl)-1-(2,3,4,5,6-pentahydroxyphenyl)prop-2-en-1-one