Summary

Molecular formula: C9H8O3
SMILES: OC(=O)/C=C/c1ccc(cc1)O
InChI: InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+
InChIKey: NGSWKAQJJWESNS-ZZXKWVIFSA-N

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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

Kingdom: Organic compounds
Super class: Phenylpropanoids and polyketides
Class: Cinnamic acids and derivatives
Sub class: Hydroxycinnamic acids and derivatives

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Synonymous chemical names:
4-coumaric acid, p-coumaric acid

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External chemical identifiers:
CID_637542; CAS_501-98-4; CHEMSPIDER_553148; ZINC_ZINC000000039811; Molport_MolPort-000-860-894

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Chemical structure download