CHEBI:145772 - curcumin 4'-O-β-D-gentiotrioside

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ChEBI Name curcumin 4'-O-β-D-gentiotrioside
ChEBI ID CHEBI:145772
ChEBI ASCII Name curcumin 4'-O-beta-D-gentiotrioside
Definition A glycoside that is curcumin substituted by a β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl-(1→6)-β-D-glucopyranoside group at position 4'.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C39H50O21
Net Charge 0
Average Mass 854.808
Monoisotopic Mass 854.28446
InChI InChI=1S/C39H50O21/c1-53-23-11-17(5-9-21(23)43)3-7-19(41)13-20(42)8-4-18-6-10-22(24(12-18)54-2)57-39-36(52)33(49)30(46)27(60-39)16-56-38-35(51)32(48)29(45)26(59-38)15-55-37-34(50)31(47)28(44)25(14-40)58-37/h3-12,25-40,43-52H,13-16H2,1-2H3/b7-3+,8-4+/t25-,26-,27-,28-,29-,30-,31+,32+,33+,34-,35-,36-,37-,38-,39-/m1/s1
InChIKey NRHNDSUHHPFVQG-LJIYMGBBSA-N
SMILES O(C=1C(=CC(\C=C\C(CC(\C=C\C=2C=C(C(=CC2)O)OC)=O)=O)=CC1)OC)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)O)O)O
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.
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ChEBI Ontology
Outgoing curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) has functional parent curcumin (CHEBI:3962)
curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) has role plant metabolite (CHEBI:76924)
curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) is a aromatic ether (CHEBI:35618)
curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) is a enol (CHEBI:33823)
curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) is a enone (CHEBI:51689)
curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) is a glycoside (CHEBI:24400)
curcumin 4'-O-β-D-gentiotrioside (CHEBI:145772) is a trisaccharide derivative (CHEBI:63571)
IUPAC Name
4-[(1E,6E)-7-(4-hydroxy-3-methoxyphenyl)-3,5-dioxohepta-1,6-dien-1-yl]-2-methoxyphenyl β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl-(1→6)-β-D-glucopyranoside
Manual Xref Database
CPD-14835 MetaCyc
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Citations Waiting for Citations Types Sources
14644434 PubMed citation Europe PMC
19561332 PubMed citation Europe PMC
Last Modified
10 January 2020