Secondary metabolite:Methyl cinnamate



EOCID003409
Summary

sCentInDB Chemical identifier: EOCID003409

Chemical name: Methyl cinnamate

Molecular formula: C10H10O2

SMILES: COC(=O)/C=C/c1ccccc1

InChI: InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+

InChIKey: CCRCUPLGCSFEDV-BQYQJAHWSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Phenylpropanoids and polyketides

Class: Cinnamic acids and derivatives

Subclass: Cinnamic acid esters


Synonymous chemical name(s):
methyl-cinnamate (e), trans-methyl cinnamate, methyl cinnamate, (e)-methyl cinnamate, (e)-methylcinnamate, methyl (e)-cinnamate, methyl-(e)-chinnamate


External chemical identifier(s):
CID:637520, CHEMBL55060, CHEBI:194138, CHEMSPIDER:21105944, ZINC000000896129, FDASRS:533CV2ZCQL, MOLPORT:001-783-139, SURECHEMBL:SCHEMBL101530


Chemical structure download

2D:
2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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