CHEBI:190753 - 3,4,5-trihydroxy-6-[2-(3-phenylbut-3-en-1-yl)phenoxy]oxane-2-carboxylic acid

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ChEBI Name 3,4,5-trihydroxy-6-[2-(3-phenylbut-3-en-1-yl)phenoxy]oxane-2-carboxylic acid
ChEBI ID CHEBI:190753
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H24O7
Net Charge 0
Average Mass 400.427
Monoisotopic Mass 400.15220
InChI InChI=1S/C22H24O7/c1-13(14-7-3-2-4-8-14)11-12-15-9-5-6-10-16(15)28-22-19(25)17(23)18(24)20(29-22)21(26)27/h2-10,17-20,22-25H,1,11-12H2,(H,26,27)
InChIKey ZAXFIZFEAVDKCA-UHFFFAOYSA-N
SMILES O1C(OC=2C(CCC(C3=CC=CC=C3)=C)=CC=CC2)C(O)C(O)C(O)C1C(O)=O
Metabolite of Species Details
Oryza sativa (NCBI:txid4530) Found in root (BTO:0001188). See: MetaboLights Study
ChEBI Ontology
Outgoing 3,4,5-trihydroxy-6-[2-(3-phenylbut-3-en-1-yl)phenoxy]oxane-2-carboxylic acid (CHEBI:190753) is a glycoside (CHEBI:24400)
IUPAC Name
3,4,5-trihydroxy-6-[2-(3-phenylbut-3-enyl)phenoxy]oxane-2-carboxylic acid
Manual Xref Database
HMDB0135566 HMDB
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