Summary
SMILES: COc1cc(OC)c(cc1c1cc(=O)c2c(o1)cc(c(c2O)OC)O)OCInChI: InChI=1S/C19H18O8/c1-23-12-8-15(25-3)14(24-2)5-9(12)13-6-10(20)17-16(27-13)7-11(21)19(26-4)18(17)22/h5-8,21-22H,1-4H3InChIKey: WGBYXADIGKYTAA-UHFFFAOYSA-N
DeepSMILES: COcccOC))ccc6ccc=O)cco6)cccc6O))OC)))O))))))))))OC
Scaffold Graph/Node/Bond level: O=c1cc(-c2ccccc2)oc2ccccc12
Scaffold Graph/Node level: OC1CC(C2CCCCC2)OC2CCCCC12
Scaffold Graph level: CC1CC(C2CCCCC2)CC2CCCCC12
Functional groups: c=O; cO; cOC; coc
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Phenylpropanoids and polyketidesClassyFire Class: Flavonoids
ClassyFire Subclass: O-methylated flavonoids
NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids
NP Classifier Superclass: Flavonoids
NP Classifier Class: Flavones
Synonymous chemical names:tabularin, tabularin(5,7-dihydroxy-6,2',4',5'-tetramethoxyflavone
External chemical identifiers:CID:44258537; ZINC:ZINC000014436599
Chemical structure download