Summary

IMPPAT Phytochemical identifier: IMPHY005961

Phytochemical name: Tyramine

Synonymous chemical names:
tyramine

External chemical identifiers:
CID:5610, ChEMBL:CHEMBL11608, ChEBI:15760, ZINC:ZINC000000002233, FDASRS:X8ZC7V0OX3, SureChEMBL:SCHEMBL4111, MolPort-000-698-914

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Chemical structure information

SMILES:
NCCc1ccc(cc1)O

InChI:
InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2

InChIKey:
DZGWFCGJZKJUFP-UHFFFAOYSA-N

DeepSMILES:
NCCcccccc6))O

Functional groups:
CN, cO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccccc1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Benzenoids

ClassyFire Class: Benzene and substituted derivatives

ClassyFire Subclass: Phenethylamines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Tyrosine alkaloids

NP Classifier Class: Phenylethylamines

NP-Likeness score: 0.758

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Chemical structure download