Structure Database (LMSD)
Common Name
6,7-methylene-pentadecanoic acid
Systematic Name
6,7-methylene-pentadecanoic acid
Synonyms
- 2-Octylcyclopropanepentanoic acid
No other lipid differing only in stereochemistry/bond geometry found
3D model of 6,7-methylene-pentadecanoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
YPMKDOYCNARBES-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H30O2/c1-2-3-4-5-6-7-10-14-13-15(14)11-8-9-12-16(17)18/h14-15H,2-13H2,1H3,(H,17,18)
SMILES (Click to copy)
C1(CCCCC(O)=O)CC1CCCCCCCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
1
Aromatic Rings
0
Rotatable Bonds
12
Van der Waals Molecular Volume
287.94
Topological Polar Surface Area
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.02
Molar Refractivity
75.69
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Created at
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Updated at
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