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CHEBI:192519 - Tetrahydoxy-flavanone pentoside

ChEBI IDCHEBI:192519
ChEBI NameTetrahydoxy-flavanone pentoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O10
Net Charge0
Average Mass420.370
Monoisotopic Mass420.10565
SMILESO=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1OC1OC[C@@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C20H20O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17-25,27H,7H2/t12-,15-,17+,18?,19?,20?/m1/s1
InChIKeyMFEQYWBUZLFDAE-ZQLVCJSTSA-N
Species of MetaboliteComponentSourceComments
Vitis (ncbitaxon:3603) berry (BTO:0000119) MetaboLights (MTBLS4202)
ChEBI Ontology
Outgoing Relation(s)
Tetrahydoxy-flavanone pentoside (CHEBI:192519) is a flavonoids (CHEBI:72544)
Tetrahydoxy-flavanone pentoside (CHEBI:192519) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(3S,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3-dihydrochromen-4-one