Structure Database (LMSD)
Common Name
trans-tetradec-11-enoic acid
Systematic Name
11E-tetradecenoic acid
Synonyms
- C14:1n-3
3D model of trans-tetradec-11-enoic 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
Reactions
Filter by species:
ⓘ
Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Spodoptera littoralis
(#7109)
Insecta
(#50557)
Possible fatty acyl pheromone precursors in Spodoptera littoralis. Search for 11- and 12-hydroxytetradecanoic acids in the pheromone gland.,
Lipids, 1997
Lipids, 1997
Pubmed ID:
9113629
Homo sapiens
(#9606)
Mammalia
(#40674)
Ozone-enabled fatty acid discovery reveals unexpected diversity in the human lipidome.,
Nat Commun, 2023
Nat Commun, 2023
Pubmed ID:
37402773
String Representations
InChiKey (Click to copy)
FWWOMPFHMRPXIH-ONEGZZNKSA-N
InChi (Click to copy)
InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h3-4H,2,5-13H2,1H3,(H,15,16)/b4-3+
SMILES (Click to copy)
O=C(O)CCCCCCCCC/C=C/CC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
0
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
263.06
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
4.55
Molar Refractivity
68.62
Admin
Created at
-
Updated at
25th Apr 2022