Structure Database (LMSD)

Common Name
Macamide
Systematic Name
N-octadecanoyl benzylamine
Synonyms
  • N-benzylstearamide
LM ID
LMFA08020156
Formula
C25H43NO
Exact Mass
Calculate m/z
373.334464
Sum Composition
NA 25:4
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 amides [FA08]
N-acyl amines [FA0802]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]
Carbocyclic fatty acids [FA0114]

String Representations

InChiKey (Click to copy)
IXODJGLAVBPVSW-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C25H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(27)26-23-24-20-17-16-18-21-24/h16-18,20-21H,2-15,19,22-23H2,1H3,(H,26,27)
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCCC)(=O)NCC1C=CC=CC=1

Other Databases

PubChem CID
220495

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 1
Aromatic Rings 1
Rotatable Bonds 18
Van der Waals Molecular Volume 427.03
Topological Polar Surface Area 29.10
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 7.56
Molar Refractivity 117.83

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Updated at
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