CHEBI:167951 - Laricitrin 3-galactoside

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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 Laricitrin 3-galactoside
ChEBI ID CHEBI:167951
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H22O13
Net Charge 0
Average Mass 494.405
Monoisotopic Mass 494.10604
InChI InChI=1S/C22H22O13/c1-32-12-3-7(2-10(26)15(12)27)20-21(17(29)14-9(25)4-8(24)5-11(14)33-20)35-22-19(31)18(30)16(28)13(6-23)34-22/h2-5,13,16,18-19,22-28,30-31H,6H2,1H3/t13-,16+,18?,19?,22-/m1/s1
InChIKey ODXINVOINFDDDD-AHHZEYPCSA-N
SMILES O1[C@@H]([C@H](O)C(O)C(O)[C@H]1OC2=C(OC=3C(C2=O)=C(O)C=C(O)C3)C=4C=C(OC)C(O)=C(O)C4)CO
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing Laricitrin 3-galactoside (CHEBI:167951) is a flavonoids (CHEBI:72544)
Laricitrin 3-galactoside (CHEBI:167951) is a glycoside (CHEBI:24400)
IUPAC Name
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-[(2R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Manual Xrefs Databases
24845158 ChemSpider
LMPK12112470 LIPID MAPS
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