Structure Database (LMSD)

Common Name
10E-Pentadecen-6,8-diynoic acid
Systematic Name
10E-Pentadecen-6,8-diynoic acid
Synonyms
  • 10-Pentadecen-6,8-diynoic acid, (E)-
LM ID
LMFA01031097
Formula
C15H20O2
Exact Mass
Calculate m/z
232.14633
Sum Composition
FA 15:5
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

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).
Reactions graph legend

String Representations

InChiKey (Click to copy)
VLPCQMHZJMTSIW-AATRIKPKSA-N
InChi (Click to copy)
InChI=1S/C15H20O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h5-6H,2-4,11-14H2,1H3,(H,16,17)/b6-5+
SMILES (Click to copy)
C(CCCCC#CC#C/C=C/CCCC)(=O)O

Other Databases

CHEBI ID
186712
PubChem CID
10443953
PlantFA ID
10592

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 7
Van der Waals Molecular Volume 269.8
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 3.38
Molar Refractivity 70.32

Admin

Created at
-
Updated at
25th Apr 2022