Summary

IMPPAT Phytochemical identifier: IMPHY014196

Phytochemical name: 9(10H)-Acridinone, 1-hydroxy-

Synonymous chemical names:
1-hydroxyacridone

External chemical identifiers:
CID:10899903, ChEMBL:CHEMBL397685, SureChEMBL:SCHEMBL9348524

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Chemical structure information

SMILES:
Oc1cccc2c1c(=O)c1c([nH]2)cccc1

InChI:
InChI=1S/C13H9NO2/c15-11-7-3-6-10-12(11)13(16)8-4-1-2-5-9(8)14-10/h1-7,15H,(H,14,16)

InChIKey:
YZTFXTYKRHQLIU-UHFFFAOYSA-N

DeepSMILES:
Occcccc6c=O)cc[nH]6)cccc6

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1c2ccccc2[nH]c2ccccc12

Scaffold Graph/Node level:
OC1C2CCCCC2NC2CCCCC21

Scaffold Graph level:
CC1C2CCCCC2CC2CCCCC21

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Quinolines and derivatives

ClassyFire Subclass: Benzoquinolines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Anthranilic acid alkaloids

NP Classifier Class: Acridone alkaloids

NP-Likeness score: 0.635

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Chemical structure download