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Secondary metabolite: 6-Hydroxy-4-oxohexyl acetate
Summary
Physicochemical properties
Drug-likeness properties
ADMET properties
Descriptors
Summary
Molecular formula:
C8H14O4
SMILES:
OCCC(=O)CCCOC(=O)C
InChI:
InChI=1S/C8H14O4/c1-7(10)12-6-2-3-8(11)4-5-9/h9H,2-6H2,1H3
InChIKey:
DMZIZFTYGQIAMJ-UHFFFAOYSA-N
Chemical classification
Kingdom:
Organic compounds
Super class:
Lipids and lipid-like molecules
Class:
Fatty Acyls
Sub class:
Fatty alcohols
Synonymous chemical names:
6-hydroxy-4-oxohexyl acetate
External chemical identifiers:
CID_139588593
;
NPATLAS_NPA019748
;
CHEMSPIDER_78435758
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
TOP
Designed by
R.P. Vivek-Ananth
, M Karthikeyan and Ajaya Kumar Sahoo