Summary

IMPPAT Phytochemical identifier: IMPHY003420

Phytochemical name: Norepinephrine

Synonymous chemical names:
l-noradrenaline, neopinephrine (noradrenaline), noradrenaline, norepinephrine, norepinephrine (ne), norepinephrine (noradrenaline)

External chemical identifiers:
CID:439260, ChEMBL:CHEMBL1437, ChEBI:18357, ZINC:ZINC000000057624, FDASRS:X4W3ENH1CV, SureChEMBL:SCHEMBL2609, MolPort-003-666-243

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Chemical structure information

SMILES:
NC[C@@H](c1ccc(c(c1)O)O)O

InChI:
InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1

InChIKey:
SFLSHLFXELFNJZ-QMMMGPOBSA-N

DeepSMILES:
NC[C@@H]cccccc6)O))O)))))O

Functional groups:
CN, CO, 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: Phenols

ClassyFire Subclass: Benzenediols

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Tyrosine alkaloids

NP Classifier Class: Phenylethylamines

NP-Likeness score: 1.194

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Chemical structure download