Structure Database (LMSD)

O OH
Common Name
22-tricosenoic acid
Systematic Name
22-tricosenoic acid
Synonyms
  • C23:1n-1
LM ID
LMFA01030091
Formula
C23H44O2
Exact Mass
Calculate m/z
352.33413
Sum Composition
FA 23:1
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

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

String Representations

InChiKey (Click to copy)
YGTSVJQQDISEHZ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C23H44O2/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/h2H,1,3-22H2,(H,24,25)
SMILES (Click to copy)
C(CCCCCCCCCCCCC(=O)O)CCCCCCCC=C

References

Other Databases

CHEBI ID
73736
LIPIDBANK ID
DFA0130
PubChem CID
543855

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 21
Van der Waals Molecular Volume 418.76
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 8.06
Molar Refractivity 110.17

Reactions

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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022