Summary

IMPPAT Phytochemical identifier: IMPHY000578

Phytochemical name: Flavone

Synonymous chemical names:
2-phenylchromone, flavone

External chemical identifiers:
CID:10680, ChEMBL:CHEMBL275638, ChEBI:42491, ZINC:ZINC000000057674, FDASRS:S2V45N7G3B, SureChEMBL:SCHEMBL18879, MolPort-001-016-955

---

Chemical structure information

SMILES:
O=c1cc(oc2c1cccc2)c1ccccc1

InChI:
InChI=1S/C15H10O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H

InChIKey:
VHBFFQKBGNRLFZ-UHFFFAOYSA-N

DeepSMILES:
O=cccocc6cccc6)))))))cccccc6

Functional groups:
c=O, coc

---

Molecular scaffolds

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

Scaffold Graph/Node level:
OC1CC(C2CCCCC2)OC2CCCCC12

Scaffold Graph level:
CC1CC(C2CCCCC2)CC2CCCCC12

---

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: 0.289

---

Chemical structure download