Structure Database (LMSD)

Common Name
15-methoxy-tricosanoic acid
Systematic Name
15-methoxy-tricosanoic acid
Synonyms
LM ID
LMFA01080016
Formula
C24H48O3
Exact Mass
Calculate m/z
384.360345
Sum Composition
FA 24:0;O
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View NP-MRD ID(NMR) spectrum

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Methoxy fatty acids [FA0108]

String Representations

InChiKey (Click to copy)
XAHQMQMCLFTERG-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C24H48O3/c1-3-4-5-6-14-17-20-23(27-2)21-18-15-12-10-8-7-9-11-13-16-19-22-24(25)26/h23H,3-22H2,1-2H3,(H,25,26)
SMILES (Click to copy)
C(CCCCCCCCCCCC(OC)CCCCCCCC)CC(O)=O

Other Databases

PubChem CID
15389272

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 0
Aromatic Rings 0
Rotatable Bonds 22
Van der Waals Molecular Volume 447.49
Topological Polar Surface Area 46.53
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
logP 8.19
Molar Refractivity 116.96

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Updated at
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