Structure Database (LMSD)
Common Name
6-isopentyl-9-methyl-5-decenoic acid
Systematic Name
6-isopentyl-9-methyl-5-decenoic acid
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 6-isopentyl-9-methyl-5-decenoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
KELKYPRDCHFVOX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H30O2/c1-13(2)9-11-15(12-10-14(3)4)7-5-6-8-16(17)18/h7,13-14H,5-6,8-12H2,1-4H3,(H,17,18)
SMILES (Click to copy)
CC(C)CC/C(/CCC(C)C)=C/CCCC(=O)O
References
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
297.66
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.04
Molar Refractivity
77.71
Admin
Created at
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Updated at
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