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CHEBI:18330 - isovitexin

Default Structure
ChEBI IDCHEBI:18330
ChEBI Nameisovitexin
Stars
DefinitionA C-glycosyl compound that consists of apigenin substituted by a 1,5-anhydro-D-glucitol moiety at position 6.
Secondary ChEBI IDsCHEBI:2771, CHEBI:14482, CHEBI:22806
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H20O10
Net Charge0
Average Mass432.381
Monoisotopic Mass432.10565
SMILESO=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
InChIInChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1
InChIKeyMYXNWGACZJSMBT-VJXVFPJBSA-N
Wikipedia
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
EC 3.2.1.20 (alpha-glucosidase) inhibitor  An EC 3.2.1.* (glycosidase) inhibitor that interferes with the action of α-glucosidase (EC 3.2.1.20).
ChEBI Ontology
Outgoing Relation(s)
isovitexin (CHEBI:18330) has functional parent apigenin (CHEBI:18388)
isovitexin (CHEBI:18330) has role EC 3.2.1.20 (α-glucosidase) inhibitor (CHEBI:67239)
isovitexin (CHEBI:18330) has role metabolite (CHEBI:25212)
isovitexin (CHEBI:18330) is a C-glycosyl compound (CHEBI:20857)
isovitexin (CHEBI:18330) is a trihydroxyflavone (CHEBI:27116)
isovitexin (CHEBI:18330) is conjugate acid of isovitexin-7-olate (CHEBI:58447)
Incoming Relation(s)
2''-O-(6-feruloylglucosyl)isovitexin (CHEBI:75554) has functional parent isovitexin (CHEBI:18330)
2''-O-(6-sinapoylglucosyl)isovitexin (CHEBI:75428) has functional parent isovitexin (CHEBI:18330)
2''-O-(β-D-glucosyl)isovitexin (CHEBI:75432) has functional parent isovitexin (CHEBI:18330)
4'-O-β-glucosyl-7-O-(6-O-sinapoylglucosyl)isovitexin (CHEBI:75564) has functional parent isovitexin (CHEBI:18330)
7-O-(6-sinapoylglucosyl)isovitexin (CHEBI:75413) has functional parent isovitexin (CHEBI:18330)
7-O-(β-D-glucosyl)isovitexin (CHEBI:75439) has functional parent isovitexin (CHEBI:18330)
7-O-[6-(6-methoxycaffeoyl)glucosyl]isovitexin (CHEBI:75420) has functional parent isovitexin (CHEBI:18330)
7-O-[α-L-rhamnosyl-(1→2)-β-D-glucosyl]isovitexin (CHEBI:75438) has functional parent isovitexin (CHEBI:18330)
isovitexin 2''-O-arabinoside (CHEBI:75435) has functional parent isovitexin (CHEBI:18330)
isovitexin 2''-O-rhamnoside (CHEBI:142906) has functional parent isovitexin (CHEBI:18330)
isovitexin 2''-O-β-D-glucoside (CHEBI:17379) has functional parent isovitexin (CHEBI:18330)
isovitexin 7-O-[feruloyl]-glucoside (CHEBI:75368) has functional parent isovitexin (CHEBI:18330)
isovitexin 7-O-[isoferuloyl]-glucoside (CHEBI:75371) has functional parent isovitexin (CHEBI:18330)
isovitexin 8-C-β-glucoside (CHEBI:69814) has functional parent isovitexin (CHEBI:18330)
sinapoyl-isovitexin 2''-O-arabinoside (CHEBI:75386) has functional parent isovitexin (CHEBI:18330)
vicenin-3 (CHEBI:142905) has functional parent isovitexin (CHEBI:18330)
isovitexin-7-olate (CHEBI:58447) is conjugate base of isovitexin (CHEBI:18330)
IUPAC Name 
(1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol
Synonyms  Source
6-C-GlucosylapigeninKEGG COMPOUND
6-GlucosylapigeninChemIDplus
Apigenin 6-C-glucosideKEGG COMPOUND
Apigenin-6-C-glucosideKEGG COMPOUND
beta-D-isovitexinChEBI
IsovitexinKEGG COMPOUND
Manual XrefsDatabases
C00001059KNApSAcK
C01714KEGG COMPOUND
IsovitexinWikipedia
ISOVITEXINMetaCyc
LMPK12110338LIPID MAPS
Registry NumbersSources
Reaxys:66651Reaxys
CAS:29702-25-8KEGG COMPOUND
CAS:38953-85-4KEGG COMPOUND
Citations