Summary

IMPPAT Phytochemical identifier: IMPHY007362

Phytochemical name: Noractinidine

Synonymous chemical names:
4-noractinidine

External chemical identifiers:
CID:92468113

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Chemical structure information

SMILES:
C[C@H]1CCc2c1cncc2

InChI:
InChI=1S/C9H11N/c1-7-2-3-8-4-5-10-6-9(7)8/h4-7H,2-3H2,1H3/t7-/m0/s1

InChIKey:
AYEYWOSWHMHDSZ-ZETCQYMHSA-N

DeepSMILES:
C[C@H]CCcc5cncc6

Functional groups:
cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1cc2c(cn1)CCC2

Scaffold Graph/Node level:
C1CC2CCNCC2C1

Scaffold Graph level:
C1CCC2CCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Pyridines and derivatives

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Nicotinic acid alkaloids

NP Classifier Class: Pyridine alkaloids

NP-Likeness score: 0.496

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Chemical structure download