CHEBI:172736 - Resveratrol 4'-(6-galloylglucoside)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Resveratrol 4'-(6-galloylglucoside)
ChEBI ID CHEBI:172736
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H26O12
Net Charge 0
Average Mass 542.493
Monoisotopic Mass 542.14243
InChI InChI=1S/C27H26O12/c28-16-7-14(8-17(29)11-16)2-1-13-3-5-18(6-4-13)38-27-25(35)24(34)23(33)21(39-27)12-37-26(36)15-9-19(30)22(32)20(31)10-15/h1-11,21,23-25,27-35H,12H2/b2-1-
InChIKey HQQSMUBDNVIUPF-UPHRSURJSA-N
SMILES O1C(C(O)C(O)C(O)C1OC2=CC=C(C=C2)/C=C\C3=CC(O)=CC(O)=C3)COC(=O)C4=CC(O)=C(O)C(O)=C4
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing Resveratrol 4'-(6-galloylglucoside) (CHEBI:172736) is a glycoside (CHEBI:24400)
Resveratrol 4'-(6-galloylglucoside) (CHEBI:172736) is a stilbenoid (CHEBI:26776)
IUPAC Name
[6-[4-[(Z)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Manual Xref Database
HMDB0034687 HMDB
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