Structure Database (LMSD)

Common Name
8Z-nonadecenoic acid
Systematic Name
8Z-nonadecenoic acid
Synonyms
LM ID
LMFA01031294
Formula
C19H36O2
Exact Mass
Calculate m/z
296.27153
Sum Composition
FA 19:1
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)
NDWUATIHOSFJIE-QXMHVHEDSA-N
InChi (Click to copy)
InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h11-12H,2-10,13-18H2,1H3,(H,20,21)/b12-11-
SMILES (Click to copy)
C(CCCCCC/C=C\CCCCCCCCCC)(=O)O

Other Databases

PubChem CID
171117692

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 349.56
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 6.50
Molar Refractivity 91.70

Admin

Created at
14th Jul 2023
Updated at
14th Jul 2023