CHEBI:66906 - 2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside

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ChEBI Name 2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside
ChEBI ID CHEBI:66906
ChEBI ASCII Name 2',4,4',6'-tetrahydroxychalcone 4'-O-beta-D-glucoside
Definition A β-D-glucoside in which a β-D-glucopyranosyl residue is attached at position 4' of 2',4,4',6'-tetrahydroxychalcone via a glycosidic linkage.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
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Formula C21H22O10
Net Charge 0
Average Mass 434.39340
Monoisotopic Mass 434.12130
InChI InChI=1S/C21H22O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-12-7-14(25)17(15(26)8-12)13(24)6-3-10-1-4-11(23)5-2-10/h1-8,16,18-23,25-29H,9H2/b6-3+/t16-,18-,19+,20-,21-/m1/s1
InChIKey ZYUSTWOCCKABCY-JSYAWONVSA-N
SMILES OC[C@H]1O[C@@H](Oc2cc(O)c(C(=O)\C=C\c3ccc(O)cc3)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing 2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside (CHEBI:66906) has functional parent 2',4,4',6'-tetrahydroxychalcone (CHEBI:15413)
2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside (CHEBI:66906) is a β-D-glucoside (CHEBI:22798)
2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside (CHEBI:66906) is conjugate acid of 2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside(1−) (CHEBI:77978)
Incoming 2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside(1−) (CHEBI:77978) is conjugate base of 2',4,4',6'-tetrahydroxychalcone 4'-O-β-D-glucoside (CHEBI:66906)
IUPAC Name
3,5-dihydroxy-4-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenyl β-D-glucopyranoside
Synonyms Sources
Chalconaringenin 4'-glucoside KEGG COMPOUND
naringenin chalcone 4'-O-glucoside MetaCyc
THC 4'-glucoside KEGG COMPOUND
Manual Xrefs Databases
C16407 KEGG COMPOUND
CPD-8632 MetaCyc
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Registry Number Type Source
65704 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
16832053 PubMed citation SUBMITTER
Last Modified
22 June 2018