Summary

IMPPAT Phytochemical identifier: IMPHY001996

Phytochemical name: 7-Hydroxyquinoline

Synonymous chemical names:
7-hydroxyquinoline

External chemical identifiers:
CID:11378

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Chemical structure information

SMILES:
O=c1ccc2-c(c1)[nH]ccc2

InChI:
InChI=1S/C9H7NO/c11-8-4-3-7-2-1-5-10-9(7)6-8/h1-6,10H

InChIKey:
QUUFTOGCVYWGNK-UHFFFAOYSA-N

DeepSMILES:
O=cccc-cc6)[nH]ccc6

Functional groups:
c=O, c[nH]c

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1ccc2ccc[nH]c-2c1

Scaffold Graph/Node level:
OC1CCC2CCCNC2C1

Scaffold Graph level:
CC1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Quinolines and derivatives

ClassyFire Subclass: Hydroquinolines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Nicotinic acid alkaloids

NP Classifier Class: Pyridine alkaloids

NP-Likeness score: -0.213

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Chemical structure download