CHEBI:172635 - Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside

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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 Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside
ChEBI ID CHEBI:172635
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H26O9
Net Charge 0
Average Mass 398.408
Monoisotopic Mass 398.15768
InChI InChI=1S/C19H26O9/c1-9(2)4-5-10-6-11(18(25)26-3)7-12(14(10)21)27-19-17(24)16(23)15(22)13(8-20)28-19/h4,6-7,13,15-17,19-24H,5,8H2,1-3H3
InChIKey OZKMIACEGRRXQA-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC=2C(O)=C(C=C(C2)C(OC)=O)CC=C(C)C)CO
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
Roles Classification
Application(s): astringent
A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.
(via tannin )
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ChEBI Ontology
Outgoing Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside (CHEBI:172635) is a tannin (CHEBI:26848)
IUPAC Name
methyl 4-hydroxy-3-(3-methylbut-2-enyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate
Manual Xref Database
HMDB0040121 HMDB
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