Summary

IMPPAT Phytochemical identifier: IMPHY004354

Phytochemical name: Cudraflavone C

Synonymous chemical names:
2',4',5,7-tetrahydroxy-6-(3-methyl-but-3-enyl)-flavone

External chemical identifiers:
CID:5319924, ChEMBL:CHEMBL485777, ChEBI:68023

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Chemical structure information

SMILES:
CC(=CCc1c(oc2c(c1=O)c(O)c(c(c2)O)CC=C(C)C)c1ccc(cc1O)O)C

InChI:
InChI=1S/C25H26O6/c1-13(2)5-8-16-20(28)12-21-22(23(16)29)24(30)18(9-6-14(3)4)25(31-21)17-10-7-15(26)11-19(17)27/h5-7,10-12,26-29H,8-9H2,1-4H3

InChIKey:
MUUDYSFWQUSAOO-UHFFFAOYSA-N

DeepSMILES:
CC=CCccoccc6=O))cO)ccc6)O))CC=CC)C)))))))))cccccc6O)))O)))))))))C

Functional groups:
CC=C(C)C, c=O, cO, coc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1cc(-c2ccccc2)oc2ccccc12

Scaffold Graph/Node level:
OC1CC(C2CCCCC2)OC2CCCCC12

Scaffold Graph level:
CC1CC(C2CCCCC2)CC2CCCCC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Phenylpropanoids and polyketides

ClassyFire Class: Flavonoids

ClassyFire Subclass: Flavones

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP Classifier Superclass: Flavonoids

NP Classifier Class: Flavones

NP-Likeness score: 1.758

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Chemical structure download