Structure Database (LMSD)
Common Name
Dioleoylethanolamine
Systematic Name
N-9Z-octadecenoyl-N-(2-hydroxyethyl)-9Z-octadecenamide
Synonyms
3D model of Dioleoylethanolamine
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Comments
Submitted by E. Camera
String Representations
InChiKey (Click to copy)
BFSFOXVFLAJGQM-CLFAGFIQSA-N
InChi (Click to copy)
InChI=1S/C38H71NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(41)39(35-36-40)38(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,40H,3-16,21-36H2,1-2H3/b19-17-,20-18-
SMILES (Click to copy)
N(C(=O)CCCCCCC/C=C\CCCCCCCC)(C(=O)CCCCCCC/C=C\CCCCCCCC)CCO
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
42
Rings
Aromatic Rings
Rotatable Bonds
32
Van der Waals Molecular Volume
692.77
Topological Polar Surface Area
57.61
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
logP
11.98
Molar Refractivity
183.69
Admin
Created at
11th Mar 2024
Updated at
6th Nov 2024