Secondary metabolite:Isoamyl isovalerate



EOCID000409
Summary

sCentInDB Chemical identifier: EOCID000409

Chemical name: Isoamyl isovalerate

Molecular formula: C10H20O2

SMILES: CC(CCOC(=O)CC(C)C)C

InChI: InChI=1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3

InChIKey: XINCECQTMHSORG-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Lipids and lipid-like molecules

Class: Fatty Acyls

Subclass: Fatty acid esters


Synonymous chemical name(s):
isopentyl-isovalerate, isopentyl isovalerate, 3-methylbutanoic acid 3-methylbutyl ester, isoamylisovalerate, isoamyl isovalerate, 3-methyl-butyl isovalerate


External chemical identifier(s):
CID:12613, CHEMBL3189076, CHEMSPIDER:12093, ZINC000001693629, FDASRS:16M1VA1FJY, MOLPORT:003-959-962, SURECHEMBL:SCHEMBL113763


Spectrabase ID:
9FoffEZIJy


Chemical structure download

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