Structure Database (LMSD)

Common Name
6E-pentadecenoic acid
Systematic Name
6E-pentadecenoic acid
Synonyms
  • 6-Pentadecenoic acid
  • C15:1n-9
LM ID
LMFA01030580
Formula
C15H28O2
Exact Mass
Calculate m/z
240.20893
Sum Composition
FA 15:1
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

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Homo sapiens (#9606)
Mammalia (#40674)
Ozone-enabled fatty acid discovery reveals unexpected diversity in the human lipidome.,
Nat Commun, 2023
Pubmed ID: 37402773

String Representations

InChiKey (Click to copy)
VQDOIVGYJXZOQY-MDZDMXLPSA-N
InChi (Click to copy)
InChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h9-10H,2-8,11-14H2,1H3,(H,16,17)/b10-9+
SMILES (Click to copy)
C(CCCC/C=C/CCCCCCCC)(=O)O

Other Databases

LIPIDAT ID
6129
PubChem CID
5312702

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 280.36
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 4.94
Molar Refractivity 73.24

Admin

Created at
-
Updated at
19th Jul 2023