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CHEBI:16631 - vitexin 2''-O-β-D-glucoside

ChEBI IDCHEBI:16631
ChEBI Namevitexin 2''-O-β-D-glucoside
Stars
ASCII Namevitexin 2''-O-beta-D-glucoside
DefinitionA disaccharide derivative that is the 2''-O-glucosyl derivative of vitexin.
Secondary ChEBI IDsCHEBI:10013, CHEBI:15316, CHEBI:27309
Last Modified28 July 2014
DownloadsMolfile
FormulaC27H30O15
Net Charge0
Average Mass594.522
Monoisotopic Mass594.15847
SMILESO=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
InChIInChI=1S/C27H30O15/c28-7-15-20(35)22(37)26(42-27-23(38)21(36)19(34)16(8-29)41-27)25(40-15)18-12(32)5-11(31)17-13(33)6-14(39-24(17)18)9-1-3-10(30)4-2-9/h1-6,15-16,19-23,25-32,34-38H,7-8H2/t15-,16-,19-,20-,21+,22+,23-,25+,26-,27+/m1/s1
InChIKeyFYTOTHFWELWOCG-OAFKVUNRSA-N
ChEBI Ontology
Outgoing Relation(s)
vitexin 2''-O-β-D-glucoside (CHEBI:16631) has functional parent vitexin (CHEBI:16954)
vitexin 2''-O-β-D-glucoside (CHEBI:16631) is a C-glycosyl compound (CHEBI:20857)
vitexin 2''-O-β-D-glucoside (CHEBI:16631) is a disaccharide derivative (CHEBI:63353)
vitexin 2''-O-β-D-glucoside (CHEBI:16631) is conjugate acid of vitexin 2''-O-β-D-glucoside(1−) (CHEBI:57842)
Incoming Relation(s)
vitexin 2''-O-β-D-glucoside(1−) (CHEBI:57842) is conjugate base of vitexin 2''-O-β-D-glucoside (CHEBI:16631)
IUPAC Name 
(1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-2-O-β-D-glucopyranosyl-D-glucitol
Synonyms  Source
Vitexin 2''-O-beta-D-glucosideKEGG COMPOUND
FlavosativasideKEGG COMPOUND
2''-O-GlucosylvitexinKEGG COMPOUND
Manual XrefsDatabases
C04024KEGG COMPOUND
LMPK12110248LIPID MAPS
C00006392KNApSAcK
Registry NumbersSources
Reaxys:6997398Reaxys
CAS:61360-94-9KEGG COMPOUND
Citations