Secondary metabolite:(3z)-Hexenyl benzoate



EOCID002057
Summary

sCentInDB Chemical identifier: EOCID002057

Chemical name: (3z)-Hexenyl benzoate

Molecular formula: C13H16O2

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

InChI: InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-11H,2-4H2,1H3/b11-8-

InChIKey: ALTSDDHTSDGUCM-FLIBITNWSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Benzenoids

Class: Benzene and substituted derivatives

Subclass: Benzoic acids and derivatives


Synonymous chemical name(s):
(3z)-hexenyl benzoate


External chemical identifier(s):
CID:101687121, CHEMSPIDER:73934480


Chemical structure download

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