Secondary metabolite:cis-3-Hexenyl isovalerate



EOCID000736
Summary

sCentInDB Chemical identifier: EOCID000736

Chemical name: cis-3-Hexenyl isovalerate

Molecular formula: C11H20O2

SMILES: CC/C=CCCOC(=O)CC(C)C

InChI: InChI=1S/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h5-6,10H,4,7-9H2,1-3H3/b6-5-

InChIKey: AIQLNKITFBJPFO-WAYWQWQTSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Lipids and lipid-like molecules

Class: Fatty Acyls

Subclass: Fatty acid esters


Synonymous chemical name(s):
(z)-3-hexenyl isovalerate, cis-3-hexenyl isovalerate, (3z)-hexenyl-3-methylbutanoate


External chemical identifier(s):
CID:5367681, CHEBI:172060, CHEMSPIDER:4519169, ZINC000012153709, FDASRS:L9KN8775G8, MOLPORT:003-960-127, SURECHEMBL:SCHEMBL573191


Spectrabase ID:
8HiJq1o9s2U


Chemical structure download

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