Structure Database (LMSD)
Common Name
O-palmitoylcarnitine
Systematic Name
3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate
Synonyms
- 3-(hexadecanoyloxy)-4-(trimethylammonio)butanoate
- O-hexadecanoylcarnitine
3D model of O-palmitoylcarnitine
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
XOMRRQXKHMYMOC-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3
SMILES (Click to copy)
C(CC([O-])=O)(C[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
References
Calculated Physicochemical Properties
Heavy Atoms
28
Rings
0
Aromatic Rings
0
Rotatable Bonds
20
Van der Waals Molecular Volume
447.34
Topological Polar Surface Area
66.43
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
logP
4.80
Molar Refractivity
114.40
Reactions
Filter by species:
ⓘ
Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).
![Reactions graph legend](https://lipidmaps.org/assets/images/reactions/Legend_LMSD.png)
Admin
Created at
-
Updated at
25th Apr 2022