CHEBI:192869 - Pinocembrin 5-O-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 Pinocembrin 5-O-glucoside
ChEBI ID CHEBI:192869
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C21H22O9
Net Charge 0
Average Mass 418.398
Monoisotopic Mass 418.12638
InChI InChI=1S/C21H22O9/c22-9-16-18(25)19(26)20(27)21(30-16)29-15-7-11(23)6-14-17(15)12(24)8-13(28-14)10-4-2-1-3-5-10/h1-7,13,16,18-23,25-27H,8-9H2
InChIKey VFPGPPMQCHGMCT-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC=2C3=C(OC(CC3=O)C4=CC=CC=C4)C=C(O)C2)CO
Metabolite of Species Details
Cryptomeria (NCBI:txid3368) Found in needle (BTO:0000917). of strain Cryptomeria fortunei Hooibrenk See: MetaboLights Study
ChEBI Ontology
Outgoing Pinocembrin 5-O-glucoside (CHEBI:192869) is a flavonoids (CHEBI:72544)
Pinocembrin 5-O-glucoside (CHEBI:192869) is a glycoside (CHEBI:24400)
IUPAC Name
7-hydroxy-2-phenyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual Xrefs Databases
3354696 ChemSpider
LMPK12140137 LIPID MAPS
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