Structure Database (LMSD)
Common Name
Lauroleinic acid
Systematic Name
5Z-dodecenoic acid
Synonyms
- C12:1n-7
- Denticetic acid
3D model of Lauroleinic 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)
IJBFSOLHRKELLR-FPLPWBNLSA-N
InChi (Click to copy)
InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h7-8H,2-6,9-11H2,1H3,(H,13,14)/b8-7-
SMILES (Click to copy)
C(CCC/C=C\CCCCCC)(=O)O
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Homo sapiens
(#9606)
Mammalia
(#40674)
Identification of characteristic compounds of moderate volatility in breast cancer cell lines.,
PLoS One, 2020
PLoS One, 2020
Pubmed ID:
32598404
Gastropacha quercifolia
(#1502188)
Insecta
(#50557)
Chemical structure and final steps of biosynthesis of the female sex pheromone of Gastropacha quercifolia (Lepidoptera: Lasiocampidae),
Insec Biochem Mol Biol, 1993
Insec Biochem Mol Biol, 1993
Other Databases
LIPIDAT ID
1759
HMDB ID
CHEBI ID
PubChem CID
PlantFA ID
Cayman ID
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
228.46
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
3.77
Molar Refractivity
59.39
Reactions
Filter by species:
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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).
![Reactions graph legend](https://lipidmaps.org/assets/images/reactions/Legend_LMSD.png)
Admin
Created at
-
Updated at
9th Jun 2022