CHEBI:30200 - kaempferol 3-O-β-D-glucoside

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ChEBI Name kaempferol 3-O-β-D-glucoside
ChEBI ID CHEBI:30200
ChEBI ASCII Name kaempferol 3-O-beta-D-glucoside
Definition A kaempferol O-glucoside in which a glucosyl residue is attached at position 3 of kaempferol via a β-glycosidic linkage.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Secondary ChEBI IDs CHEBI:31745, CHEBI:132836
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Formula C21H20O11
Net Charge 0
Average Mass 448.378
Monoisotopic Mass 448.10056
InChI InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1
InChIKey JPUKWEQWGBDDQB-QSOFNFLRSA-N
SMILES C1(=C(C(C2=C(C=C(C=C2O1)O)O)=O)O[C@H]3[C@H](O)[C@H]([C@@H]([C@@H](CO)O3)O)O)C=4C=CC(O)=CC4
Metabolite of Species Details
Delphinium staphisagria (NCBI:txid104301) Found in aerial part (BTO:0001658). 80% ethanolic extract of chopped fresh plant See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
trypanocidal drug
A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
Application(s): trypanocidal drug
A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
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ChEBI Ontology
Outgoing kaempferol 3-O-β-D-glucoside (CHEBI:30200) has role plant metabolite (CHEBI:76924)
kaempferol 3-O-β-D-glucoside (CHEBI:30200) has role trypanocidal drug (CHEBI:36335)
kaempferol 3-O-β-D-glucoside (CHEBI:30200) is a β-D-glucoside (CHEBI:22798)
kaempferol 3-O-β-D-glucoside (CHEBI:30200) is a kaempferol O-glucoside (CHEBI:64634)
kaempferol 3-O-β-D-glucoside (CHEBI:30200) is a monosaccharide derivative (CHEBI:63367)
kaempferol 3-O-β-D-glucoside (CHEBI:30200) is a trihydroxyflavone (CHEBI:27116)
kaempferol 3-O-β-D-glucoside (CHEBI:30200) is conjugate acid of kaempferol 3-O-β-D-glucoside(1−) (CHEBI:169942)
Incoming 2ʼʼ-acetylastragalin (CHEBI:67926) has functional parent kaempferol 3-O-β-D-glucoside (CHEBI:30200)
astragalin heptaacetate (CHEBI:67927) has functional parent kaempferol 3-O-β-D-glucoside (CHEBI:30200)
kaempferol 3-O-β-D-glucoside(1−) (CHEBI:169942) is conjugate base of kaempferol 3-O-β-D-glucoside (CHEBI:30200)
IUPAC Name
3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
Synonyms Sources
3,4',5,7-Tetrahydroxyflavone-3-glucoside ChemIDplus
4H-1-Benzopyran-4-one, 3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)- ChemIDplus
5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl β-D-glucopyranoside ChEBI
Astragalin ChemIDplus
astragaline ChEBI
Kaempferol 3-O-beta-D-glucoside KEGG COMPOUND
Kaempferol 3-O-glucoside KEGG COMPOUND
Kaempferol 3-O-glucoside KEGG COMPOUND
kaempferol-3-O-β-glucopyranoside ChEBI
Manual Xrefs Databases
Astragalin Wikipedia
C00005138 KNApSAcK
C12249 KEGG COMPOUND
CPD1F-453 MetaCyc
HMDB0037429 HMDB
LMPK12111725 LIPID MAPS
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Registry Numbers Types Sources
1359980 Reaxys Registry Number Reaxys
480-10-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
21329934 PubMed citation Europe PMC
21466157 PubMed citation Europe PMC
22210036 PubMed citation Europe PMC
22489129 PubMed citation Europe PMC
22766709 PubMed citation Europe PMC
Last Modified
26 September 2016