CHEBI:131777 - tricin 7-O-neohesperidoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name tricin 7-O-neohesperidoside
ChEBI ID CHEBI:131777
ChEBI ASCII Name tricin 7-O-neohesperidoside
Definition A glycosyloxyflavone that is 3',5'-di-O-methyltricetin (tricin) in which the phenolic hydrogen at position 7 has been replaced by a neohesperidosyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C29H34O16
Net Charge 0
Average Mass 638.572
Monoisotopic Mass 638.18469
InChI InChI=1S/C29H34O16/c1-10-21(33)24(36)26(38)28(41-10)45-27-25(37)23(35)19(9-30)44-29(27)42-12-6-13(31)20-14(32)8-15(43-16(20)7-12)11-4-17(39-2)22(34)18(5-11)40-3/h4-8,10,19,21,23-31,33-38H,9H2,1-3H3/t10-,19+,21-,23+,24+,25-,26+,27+,28-,29+/m0/s1
InChIKey AIBMPOJXBGZIPQ-QWNFCSOYSA-N
SMILES [C@H]1(O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)CO)OC3=CC4=C(C(C=C(O4)C5=CC(=C(C(=C5)OC)O)OC)=O)C(=C3)O
Metabolite of Species Details
Oryza sativa (NCBI:txid4530) Found in seed See: MetaboLights Study
Oryza sativa (NCBI:txid4530) Found in seed See: PubMed
Saccharum officinarum (NCBI:txid4547) 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing tricin 7-O-neohesperidoside (CHEBI:131777) has functional parent 3',5'-di-O-methyltricetin (CHEBI:59979)
tricin 7-O-neohesperidoside (CHEBI:131777) has role plant metabolite (CHEBI:76924)
tricin 7-O-neohesperidoside (CHEBI:131777) is a dihydroxyflavone (CHEBI:38686)
tricin 7-O-neohesperidoside (CHEBI:131777) is a dimethoxyflavone (CHEBI:23798)
tricin 7-O-neohesperidoside (CHEBI:131777) is a glycosyloxyflavone (CHEBI:50018)
tricin 7-O-neohesperidoside (CHEBI:131777) is a neohesperidoside (CHEBI:25495)
tricin 7-O-neohesperidoside (CHEBI:131777) is a polyphenol (CHEBI:26195)
IUPAC Name
5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
Synonyms Sources
7-O-[α-L-rhamnopyranosyl-(1→2)-β-D-glucopyranosyl]tricin ChEBI
7-O-[α-L-rhamnosyl-(1→2)-β-D-glucosyl]tricin ChEBI
Tricin 7-neohesperidoside LIPID MAPS
Manual Xrefs Databases
C00004462 KNApSAcK
HMDB0037462 HMDB
LMPK12110862 LIPID MAPS
View more database links
Registry Numbers Types Sources
53766-40-8 CAS Registry Number KNApSAcK
5843908 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
17019935 PubMed citation Europe PMC
19628235 PubMed citation Europe PMC
26860358 PubMed citation Europe PMC
Last Modified
18 November 2016