Detail Information

Number mr1058
Declustering Potential(DP) 60
Collision Energy(CE) 40
Observed mass(Da) 331.0811
Exact mass(Da) 331.0812
Accurate mass error(ppm) 0.39
Molecular formula C17H14O7
Ionization model
Ret. Time(min) 11.85
Precursor ions(Q1) 331.0811
Product ions(Q3) 315.0
Main fragments 315.0, 285.0, 258.0, 243.0, 153.0
Compound Tricin
Identification standard
class Flavonoid
CV(%) 97.15
H2 0.51
Agricola Citation Links
ArrayExpress Database Links
Beilstein Registry Numbers 322590;;
BioModels Database Links
CAS Registry Numbers 520-32-1;;
COMe Database Links
ChEBI Name 3',5'-di-O-methyltricetin;;
Charge 0;;
Chinese Abstracts Citation Links
CiteXplore Citation Links
Definition The 3',5'-di-O-methyl ether of tricetin. Known commonly as tricin, it is a constituent of rice bran and has been found to potently inhibit colon cancer cell growth.;;
DrugBank Database Links
Formulae C17H14O7;;
Gmelin Registry Numbers
IUPAC Names 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-chromen-4-one;;
InChI InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3;;
IntAct Database Links
IntEnz Database Links
KEGG COMPOUND Database Links
KEGG DRUG Database Links
KEGG GLYCAN Database Links
LIPID MAPS class Database Links
LIPID MAPS instance Database Links
Last Modified 10 Oct 2014;;
Mass 330.28890;;
MolBase Database Links
PDBeChem Database Links
Patent Database Links
PubChem Database Links 99319532;;
PubMed Central Citation Links
PubMed Citation Links 21469695;;
RESID Database Links
Reactome Database Links
Rhea Database Links
SABIO-RK Database Links
SMILES COc1cc(cc(OC)c1O)-c1cc(=O)c2c(O)cc(O)cc2o1;;
Secondary ChEBI ID CHEBI:9694;;
Star 3;;
Synonyms tricin;;Tricetin 3',5'-di-methyl ether;;5,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one;;3',5'-Dimethoxy-4',5,7-trihydroxyflavone;;
UM-BBD compID Database Links
UniProt Database Links Q9XGP7;;Q7F8T6;;
ChEBI Image