Structure Database (LMSD)
Common Name
Ximenic acid
Systematic Name
17Z-hexacosenoic acid
Synonyms
- cis-17-hexacosenoic acid
- C26:1n-9
3D model of Ximenic 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)
RQIDQEBURXNDKG-KTKRTIGZSA-N
InChi (Click to copy)
InChI=1S/C26H50O2/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)28/h9-10H,2-8,11-25H2,1H3,(H,27,28)/b10-9-
SMILES (Click to copy)
C(CCCCCCCCCCCCC(=O)O)CC/C=C\CCCCCCCC
References
Other Databases
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0134
PubChem CID
PlantFA ID
SwissLipids ID
Calculated Physicochemical Properties
Heavy Atoms
28
Rings
0
Aromatic Rings
0
Rotatable Bonds
23
Van der Waals Molecular Volume
470.66
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
9.23
Molar Refractivity
124.02
Reactions
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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.
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Admin
Created at
-
Updated at
25th Apr 2022