CHEBI:169424 - 3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside)

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ChEBI Name 3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside)
ChEBI ID CHEBI:169424
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H20O12
Net Charge 0
Average Mass 440.357
Monoisotopic Mass 440.09548
InChI InChI=1S/C19H20O12/c20-8-3-9(21)5-10(4-8)30-19-17(27)16(26)15(25)13(31-19)6-29-18(28)7-1-11(22)14(24)12(23)2-7/h1-5,13,15-17,19-27H,6H2
InChIKey WVHDGXKUZIDTIN-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC2=CC(O)=CC(O)=C2)COC(=O)C3=CC(O)=C(O)C(O)=C3
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 3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside) (CHEBI:169424) is a glycoside (CHEBI:24400)
IUPAC Name
[6-(3,5-dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Manual Xref Database
HMDB0039307 HMDB
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