Structure Database (LMSD)

O OH
Common Name
7Z-nonadecenoic acid
Systematic Name
7Z-nonadecenoic acid
Synonyms
  • C19:1n-12
LM ID
LMFA01030364
Formula
C19H36O2
Exact Mass
Calculate m/z
296.27153
Sum Composition
FA 19:1
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)
MBSJMRUSWQBXNI-SEYXRHQNSA-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/h12-13H,2-11,14-18H2,1H3,(H,20,21)/b13-12-
SMILES (Click to copy)
C(CCCCC/C=C\CCCCCCCCCCC)(=O)O

References

Other Databases

LIPIDAT ID
7567
PubChem CID
5312515

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

Reactions

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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022