Structure Database (LMSD)
Common Name
Sabinic acid
Systematic Name
12-hydroxy-dodecanoic acid
Synonyms
- 12-hydroxy lauric acid
3D model of Sabinic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Biological Context
12-hydroxy Lauric acid is a hydroxylated fatty acid that has been found in honey bee royal jelly.1 It is active against S. aureus, B. subtilis, B. cereus, E. coli, and P. aeruginosa bacteria (MICs = 6.25-125 μg/ml) and the fungus C. albicans (MIC = 15.63 μg/ml).
This information has been provided by Cayman Chemical
References
1. Isidorov, W., Witkowski, S., Zambrzycka, M., et al. Royal jelly aliphatic acids contribute to antimicrobial activity of honey. J. Apic. Sci. 62(1), 111-123 (2018).
String Representations
InChiKey (Click to copy)
ZDHCZVWCTKTBRY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15)
SMILES (Click to copy)
C(CCCCCCCCCO)CC(=O)O
Other Databases
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0305
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID
PDB ID
GuidePharm ID
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
239.89
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
3.25
Molar Refractivity
61.38
Admin
Created at
-
Updated at
-