Summary

IMPPAT Phytochemical identifier: IMPHY011949

Phytochemical name: cis-Cinnamic acid

Synonymous chemical names:
(z)-cinnamic acid

External chemical identifiers:
CID:5372954, ChEBI:35699, ZINC:ZINC000004532783, SureChEMBL:SCHEMBL3406486, MolPort-028-616-992

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Chemical structure information

SMILES:
OC(=O)/C=Cc1ccccc1

InChI:
InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6-

InChIKey:
WBYWAXJHAXSJNI-SREVYHEPSA-N

DeepSMILES:
OC=O)/C=Ccccccc6

Functional groups:
c/C=CC(=O)O

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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: Phenylpropanoids and polyketides

ClassyFire Class: Cinnamic acids and derivatives

ClassyFire Subclass: Cinnamic acids

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP Classifier Superclass: Phenylpropanoids (C6-C3)

NP Classifier Class: Cinnamic acids and derivatives

NP-Likeness score: 0.404

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Chemical structure download