Summary

IMPPAT Phytochemical identifier: IMPHY007719

Phytochemical name: Canavalmine

Synonymous chemical names:
canavalmine

External chemical identifiers:
CID:125776, SureChEMBL:SCHEMBL3054702

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Chemical structure information

SMILES:
NCCCCNCCCNCCCCN

InChI:
InChI=1S/C11H28N4/c12-6-1-3-8-14-10-5-11-15-9-4-2-7-13/h14-15H,1-13H2

InChIKey:
RZOHQCYUTFAJLA-UHFFFAOYSA-N

DeepSMILES:
NCCCCNCCCNCCCCN

Functional groups:
CN, CNC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic nitrogen compounds

ClassyFire Class: Organonitrogen compounds

ClassyFire Subclass: Amines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Ornithine alkaloids

NP Classifier Class: Polyamines

NP-Likeness score: 0.077

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Chemical structure download