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CHEBI:144432 - myricitrin(1−)

ChEBI IDCHEBI:144432
ChEBI Namemyricitrin(1−)
Stars
ASCII Namemyricitrin(1-)
DefinitionA flavonoid oxoanion that is the conjugate base of myricitrin arising from selective deprotonation of the 7-hydroxy group; major species at pH 7.3.
Last Modified16 September 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC21H19O12
Net Charge-1
Average Mass463.371
Monoisotopic Mass463.08820
SMILESC[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc([O-])cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/p-1/t6-,14-,17+,18+,21-/m0/s1
InChIKeyDCYOADKBABEMIQ-OWMUPTOHSA-M
ChEBI Ontology
Outgoing Relation(s)
myricitrin(1−) (CHEBI:144432) is a flavonoid oxoanion (CHEBI:60038)
myricitrin(1−) (CHEBI:144432) is conjugate base of myricitrin (CHEBI:70082)
Incoming Relation(s)
myricitrin (CHEBI:70082) is conjugate acid of myricitrin(1−) (CHEBI:144432)
Synonym  Source
myricitrin anionChEBI
UniProt Name  Source
myricetin 3-O-α-L-rhamnosideUniProt
Citations