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CHEBI:139281 - (4ξ)-2-O-(4-hydroxybenzoyl)-6-O-(3,4,5-trihydroxybenzoyl)-D-ribo-hexopyranose

ChEBI IDCHEBI:139281
ChEBI Name(4ξ)-2-O-(4-hydroxybenzoyl)-6-O-(3,4,5-trihydroxybenzoyl)-D-ribo-hexopyranose
Stars
ASCII Name(4xi)-2-O-(4-hydroxybenzoyl)-6-O-(3,4,5-trihydroxybenzoyl)-D-ribo-hexopyranose
Last Modified11 December 2017
Submittermwilliams
DownloadsMolfile
FormulaC20H20O12
Net Charge0
Average Mass452.368
Monoisotopic Mass452.09548
SMILESO=C(OC[C@H]1OC(O)[C@H](OC(=O)c2ccc(O)cc2)[C@H](O)C1O)c1cc(O)c(O)c(O)c1
InChIInChI=1S/C20H20O12/c21-10-3-1-8(2-4-10)19(28)32-17-16(26)15(25)13(31-20(17)29)7-30-18(27)9-5-11(22)14(24)12(23)6-9/h1-6,13,15-17,20-26,29H,7H2/t13-,15?,16-,17-,20?/m1/s1
InChIKeyOQZUBZJEVMCTGO-TYZOZAEZSA-N
ChEBI Ontology
Outgoing Relation(s)
(4ξ)-2-O-(4-hydroxybenzoyl)-6-O-(3,4,5-trihydroxybenzoyl)-D-ribo-hexopyranose (CHEBI:139281) is a gallate ester (CHEBI:37576)
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