Summary

IMPPAT Phytochemical identifier: IMPHY001489

Phytochemical name: Ovalifolin

Synonymous chemical names:
ovalifolin

External chemical identifiers:
CID:15160715, ZINC:ZINC000014618800

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Chemical structure information

SMILES:
CC(=CCOc1cc2c(=O)cc(oc2c2c1occ2)c1ccccc1)C

InChI:
InChI=1S/C22H18O4/c1-14(2)8-10-24-20-12-17-18(23)13-19(15-6-4-3-5-7-15)26-21(17)16-9-11-25-22(16)20/h3-9,11-13H,10H2,1-2H3

InChIKey:
VZSKLDHXYLNZMO-UHFFFAOYSA-N

DeepSMILES:
CC=CCOcccc=O)ccoc6cc%10occ5)))))))cccccc6)))))))))))))))C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1cc(-c2ccccc2)oc2c1ccc1occc12

Scaffold Graph/Node level:
OC1CC(C2CCCCC2)OC2C1CCC1OCCC12

Scaffold Graph level:
CC1CC(C2CCCCC2)CC2C1CCC1CCCC12

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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: 1.212

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Chemical structure download