Summary

IMPPAT Phytochemical identifier: IMPHY015782

Phytochemical name: Kanzonol V

Synonymous chemical names:
kanzonol v

External chemical identifiers:
CID:102444980, ChEBI:175838, ZINC:ZINC000085955990

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Chemical structure information

SMILES:
CC(=CCc1cc2cc(oc2cc1O)c1ccc(c2c1OC(C)(C)C=C2)O)C

InChI:
InChI=1S/C24H24O4/c1-14(2)5-6-15-11-16-12-22(27-21(16)13-20(15)26)18-7-8-19(25)17-9-10-24(3,4)28-23(17)18/h5,7-13,25-26H,6H2,1-4H3

InChIKey:
AKOSXIFOBUWPLU-UHFFFAOYSA-N

DeepSMILES:
CC=CCcccccoc5cc9O)))))cccccc6OCC)C)C=C6))))))O))))))))))))C

Functional groups:
CC=C(C)C, cC=CC, cO, cOC, coc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=Cc2cccc(-c3cc4ccccc4o3)c2OC1

Scaffold Graph/Node level:
C1CCC2OC(C3CCCC4CCCOC43)CC2C1

Scaffold Graph level:
C1CCC2CC(C3CCCC4CCCCC43)CC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Phenylpropanoids and polyketides

ClassyFire Class: 2-arylbenzofuran flavonoids

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP Classifier Superclass: Isoflavonoids

NP Classifier Class: 2-arylbenzofurans

NP-Likeness score: 2.329

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Chemical structure download