Structure Database (LMSD)

Common Name
2-pentadecenoic acid
Systematic Name
2-pentadecenoic acid
Synonyms
  • C15:1n-13
LM ID
LMFA01030052
Formula
C15H28O2
Exact Mass
Calculate m/z
240.20893
Sum Composition
FA 15:1
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

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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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Reactions graph legend

String Representations

InChiKey (Click to copy)
HOGWBMWOBRRKCD-BUHFOSPRSA-N
InChi (Click to copy)
InChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h13-14H,2-12H2,1H3,(H,16,17)/b14-13+
SMILES (Click to copy)
C(CCCCC)CCCCCC/C=C/C(=O)O

Other Databases

CHEBI ID
78992
LIPIDBANK ID
DFA0091
PubChem CID
5282742

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 280.36
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 4.94
Molar Refractivity 73.24

Admin

Created at
-
Updated at
25th Apr 2022