CHEBI:181286 - [4-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

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ChEBI Name [4-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate
ChEBI ID CHEBI:181286
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C24H30O11
Net Charge 0
Average Mass 494.493
Monoisotopic Mass 494.17881
InChI InChI=1S/C24H30O11/c1-13(26)24(32,10-14-2-6-16(27)7-3-14)23(31)33-12-15-4-8-17(9-5-15)34-22-21(30)20(29)19(28)18(11-25)35-22/h2-9,13,18-22,25-30,32H,10-12H2,1H3
InChIKey FKMASXTUONWHBB-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC2=CC=C(COC(=O)C(O)(CC3=CC=C(O)C=C3)C(O)C)C=C2)CO
ChEBI Ontology
Outgoing [4-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate (CHEBI:181286) is a glycoside (CHEBI:24400)
IUPAC Name
[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate