CHEBI:167966 - Laricitrin 3-(6''-acetylglucoside)

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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-(6''-acetylglucoside)
ChEBI ID CHEBI:167966
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H24O14
Net Charge 0
Average Mass 536.442
Monoisotopic Mass 536.11661
InChI InChI=1S/C24H24O14/c1-8(25)35-7-15-18(30)20(32)21(33)24(37-15)38-23-19(31)16-11(27)5-10(26)6-13(16)36-22(23)9-3-12(28)17(29)14(4-9)34-2/h3-6,15,18,20-21,24,26-30,32-33H,7H2,1-2H3/t15-,18-,20?,21?,24-/m1/s1
InChIKey POSCXXNRWPAPHO-QKBIWBOTSA-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)COC(=O)C
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-(6''-acetylglucoside) (CHEBI:167966) is a flavonoids (CHEBI:72544)
Laricitrin 3-(6''-acetylglucoside) (CHEBI:167966) is a glycoside (CHEBI:24400)
IUPAC Name
[(2R,3S,6R)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Manual Xrefs Databases
24845164 ChemSpider
LMPK12112476 LIPID MAPS
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