Summary

IMPPAT Phytochemical identifier: IMPHY003234

Phytochemical name: Benzo[c]phenanthridine

Synonymous chemical names:
benzo (c) phenanthridine

External chemical identifiers:
CID:344234, ZINC:ZINC000001593776, SureChEMBL:SCHEMBL241747

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Chemical structure information

SMILES:
c1ccc2c(c1)cnc1c2ccc2c1cccc2

InChI:
InChI=1S/C17H11N/c1-4-8-15-12(5-1)9-10-16-14-7-3-2-6-13(14)11-18-17(15)16/h1-11H

InChIKey:
XPDJLGHACUMTKU-UHFFFAOYSA-N

DeepSMILES:
cccccc6)cncc6cccc6cccc6

Functional groups:
cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)cnc1c3ccccc3ccc21

Scaffold Graph/Node level:
C1CCC2C(C1)CNC1C3CCCCC3CCC21

Scaffold Graph level:
C1CCC2C(C1)CCC1C3CCCCC3CCC21

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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: Shikimates and Phenylpropanoids

NP Classifier Superclass: Phenanthrenoids

NP Classifier Class: Phenanthrenes

NP-Likeness score: -0.234

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Chemical structure download