CHEBI:190073 - Luteolin 4'-glucoside 7-galacturonide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Luteolin 4'-glucoside 7-galacturonide
ChEBI ID CHEBI:190073
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H28O17
Net Charge 0
Average Mass 624.504
Monoisotopic Mass 624.13265
InChI InChI=1S/C27H28O17/c28-7-16-18(32)19(33)22(36)27(43-16)42-13-2-1-8(3-10(13)29)14-6-12(31)17-11(30)4-9(5-15(17)41-14)40-26-23(37)20(34)21(35)24(44-26)25(38)39/h1-6,16,18-24,26-30,32-37H,7H2,(H,38,39)
InChIKey DUNZXXOAZWJFBE-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC2=C(O)C=C(C=C2)C=3OC4=CC(OC5OC(C(O)C(O)C5O)C(O)=O)=CC(O)=C4C(=O)C3)CO
Metabolite of Species Details
Brassica napus (NCBI:txid3708) Found in flower (BTO:0000469). See: MetaboLights Study
ChEBI Ontology
Outgoing Luteolin 4'-glucoside 7-galacturonide (CHEBI:190073) is a flavonoids (CHEBI:72544)
Luteolin 4'-glucoside 7-galacturonide (CHEBI:190073) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name
3,4,5-trihydroxy-6-[5-hydroxy-2-[3-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid
Manual Xref Database
HMDB0038809 HMDB
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