Summary

IMPPAT Phytochemical identifier: IMPHY013964

Phytochemical name: Guanidine-3-propanol

Synonymous chemical names:
pg 3

External chemical identifiers:
CID:448503

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Chemical structure information

SMILES:
OCCC[NH+]=C(N)N

InChI:
InChI=1S/C4H11N3O/c5-4(6)7-2-1-3-8/h8H,1-3H2,(H4,5,6,7)/p+1

InChIKey:
JDXXTKLHHZMVIO-UHFFFAOYSA-O

DeepSMILES:
OCCC[NH+]=CN)N

Functional groups:
CO, C[NH+]=C(N)N

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic nitrogen compounds

ClassyFire Class: Organonitrogen compounds

ClassyFire Subclass: Guanidines

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids, Amino acids and Peptides

NP Classifier Superclass: Small peptides

NP Classifier Class: Aminoacids

NP-Likeness score: 0.484

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Chemical structure download