Structure Database (LMSD)

Common Name
5Z-pentacosenoic acid
Systematic Name
5Z-pentacosenoic acid
Synonyms
LM ID
LMFA01031120
Formula
C25H48O2
Exact Mass
Calculate m/z
380.36543
Sum Composition
FA 25:1
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
Trikentrion (#484443)
Demospongiae (#6042)
Fatty acids, fatty acid analogues and their derivatives,
Nat Prod Rep, 1998

String Representations

InChiKey (Click to copy)
NLNVSLYJIFQEBK-MRCUWXFGSA-N
InChi (Click to copy)
InChI=1S/C25H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27/h20-21H,2-19,22-24H2,1H3,(H,26,27)/b21-20-
SMILES (Click to copy)
C(CCC/C=C\CCCCCCCCCCCCCCCCCCC)(=O)O

Other Databases

PubChem CID
21774058

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 0
Aromatic Rings 0
Rotatable Bonds 22
Van der Waals Molecular Volume 453.36
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 8.84
Molar Refractivity 119.41

Admin

Created at
-
Updated at
25th Apr 2022