Summary

IMPPAT Phytochemical identifier: IMPHY003045

Phytochemical name: 1-Methyl-9(10H)-acridinone

Synonymous chemical names:
methylacridone

External chemical identifiers:
CID:419816, SureChEMBL:SCHEMBL11032998

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Chemical structure information

SMILES:
Cc1cccc2c1c(=O)c1c([nH]2)cccc1

InChI:
InChI=1S/C14H11NO/c1-9-5-4-8-12-13(9)14(16)10-6-2-3-7-11(10)15-12/h2-8H,1H3,(H,15,16)

InChIKey:
CVLMVMQNJODBLJ-UHFFFAOYSA-N

DeepSMILES:
Ccccccc6c=O)cc[nH]6)cccc6

Functional groups:
c=O, 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: 0.126

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Chemical structure download