Summary

Molecular formula: C11H12O5
SMILES: COc1cc(/C=C/C(=O)O)cc(c1O)OC
InChI: InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+
InChIKey: PCMORTLOPMLEFB-ONEGZZNKSA-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:
sinapic acid

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External chemical identifiers:
CID_637775; CAS_7362-37-0; CHEMSPIDER_553361; ZINC_ZINC000000153654; Molport_MolPort-000-154-620

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Chemical structure download