Summary

IMPPAT Phytochemical identifier: IMPHY015429

Phytochemical name: 6-Aminobenzo[g]quinoxaline-5,10-dione

Synonymous chemical names:
6-aminobenzo(g) quinoxaline-5,10-dione

External chemical identifiers:
CID:338713, SureChEMBL:SCHEMBL11402335

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Chemical structure information

SMILES:
Nc1cccc2c1C(=O)c1nccnc1C2=O

InChI:
InChI=1S/C12H7N3O2/c13-7-3-1-2-6-8(7)12(17)10-9(11(6)16)14-4-5-15-10/h1-5H,13H2

InChIKey:
KNIQIOWAIMJMLY-UHFFFAOYSA-N

DeepSMILES:
Ncccccc6C=O)cnccnc6C%10=O

Functional groups:
cC(c)=O, cN, cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1c2ccccc2C(=O)c2nccnc21

Scaffold Graph/Node level:
OC1C2CCCCC2C(O)C2NCCNC12

Scaffold Graph level:
CC1C2CCCCC2C(C)C2CCCCC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Benzenoids

ClassyFire Class: Naphthalenes

NP Classifier Biosynthetic pathway: Alkaloids

NP-Likeness score: 0.25

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Chemical structure download