In-Silico Structure Database (LMISSD)
Common Name
Ala 13:0
Systematic Name
N-(tridecanoyl)-alanine
LM ID
LMFA0805A004
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
285.230394
Formula
Main
Classification
Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty amides [FA08]
N-acyl amino acids [FA0805]
String Representations
InChiKey (Click to copy)
LPXFRIFRJBSPNJ-AWEZNQCLSA-N
InChi (Click to copy)
InChI=1S/C16H31NO3/c1-3-4-5-6-7-8-9-10-11-12-13-15(18)17-14(2)16(19)20/h14H,3-13H2,1-2H3,(H,17,18)(H,19,20)/t14-/m0/s1
SMILES (Click to copy)
CCCCCCCCCCCCC(=N[C@@H](C)C(=O)O)O