Structure Database (LMSD)
Common Name
Hormelic acid
Systematic Name
15-(cyclopent-2-en-1-yl)pentadecanoic acid
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Hormelic 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)
LKHZDPAUGRFBHR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C20H36O2/c21-20(22)18-12-10-8-6-4-2-1-3-5-7-9-11-15-19-16-13-14-17-19/h13,16,19H,1-12,14-15,17-18H2,(H,21,22)
SMILES (Click to copy)
C(O)(=O)CCCCCCCCCCCCCCC1CCC=C1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Caloncoba echinata
(#312426)
Magnoliopsida
(#3398)
New cyclopentenyl fatty acids in Flacourtiaceae. Straight-chain fatty acids and cyclic fatty acids in lipids during maturation of the seeds.,
Biochemistry, 1974
Biochemistry, 1974
Pubmed ID:
4364774
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
22
Rings
1
Aromatic Rings
0
Rotatable Bonds
15
Van der Waals Molecular Volume
354.5
Topological Polar Surface Area
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
6.5
Molar Refractivity
94.14
Admin
Created at
-
Updated at
13th Apr 2021