Structure Database (LMSD)
Common Name
28-hydroxy-octacosanoic acid
Systematic Name
28-hydroxy-octacosanoic acid
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 28-hydroxy-octacosanoic 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)
DQDKWDYKDPDWMY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C28H56O3/c29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28(30)31/h29H,1-27H2,(H,30,31)
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCCCCCCCCCCCCCO)(=O)O
References
Calculated Physicochemical Properties
Heavy Atoms
31
Rings
0
Aromatic Rings
0
Rotatable Bonds
27
Van der Waals Molecular Volume
516.69
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
9.49
Molar Refractivity
135.25
Admin
Created at
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Updated at
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