Structure Database (LMSD)
Common Name
18-methyl-iso-25:0
Systematic Name
18,23-dimethyltetracosanoic acid
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 18-methyl-iso-25:0
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)
UVSSUMZSKXGOEN-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C26H52O2/c1-24(2)20-18-19-22-25(3)21-16-14-12-10-8-6-4-5-7-9-11-13-15-17-23-26(27)28/h24-25H,4-23H2,1-3H3,(H,27,28)
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCCC(C)CCCCC(C)C)(=O)O
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
unclassified Penares
(#2630499)
Demospongiae
(#6042)
9-Chloro-5,9-dienoic and Other Fatty Acids from Marine Sponge Penares sp.,
Russ J Bioorg Chem, 2024
Russ J Bioorg Chem, 2024
Calculated Physicochemical Properties
Heavy Atoms
28
Rings
Aromatic Rings
Rotatable Bonds
22
Van der Waals Molecular Volume
473.30
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
9.17
Molar Refractivity
123.98
Admin
Created at
26th Apr 2024
Updated at
26th Apr 2024