Summary

IMPPAT Phytochemical identifier: IMPHY016907

Phytochemical name: 4',7-Dihydroxy-3'-methylflavone

Synonymous chemical names:
4',7-dihydroxy-3'-methylflavone

External chemical identifiers:
CID:90761690

---

Chemical structure information

SMILES:
Oc1ccc2c(c1)oc(cc2=O)c1ccc(c(c1)C)O

InChI:
InChI=1S/C16H12O4/c1-9-6-10(2-5-13(9)18)15-8-14(19)12-4-3-11(17)7-16(12)20-15/h2-8,17-18H,1H3

InChIKey:
HDBRYFYCIJPNRF-UHFFFAOYSA-N

DeepSMILES:
Occcccc6)occc6=O)))cccccc6)C))O

Functional groups:
c=O, cO, 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: 0.92

---

Chemical structure download