Summary

IMPPAT Phytochemical identifier: IMPHY017545

Phytochemical name: 7-Methylquinolin-8-ol

Synonymous chemical names:
8-quinolinol, 7-methyl

External chemical identifiers:
CID:594448, ZINC:ZINC000001233329, SureChEMBL:SCHEMBL623096, MolPort-002-083-778

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Chemical structure information

SMILES:
Cc1ccc2c(c1O)nccc2

InChI:
InChI=1S/C10H9NO/c1-7-4-5-8-3-2-6-11-9(8)10(7)12/h2-6,12H,1H3

InChIKey:
LUOZEWPJSYBORW-UHFFFAOYSA-N

DeepSMILES:
Ccccccc6O))nccc6

Functional groups:
cO, cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2ncccc2c1

Scaffold Graph/Node level:
C1CCC2NCCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Quinolines and derivatives

ClassyFire Subclass: 8-hydroxyquinolines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Tryptophan alkaloids

NP-Likeness score: -0.623

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Chemical structure download