In-Silico Structure Database (LMISSD)
Common Name
Asn 11:0
Systematic Name
N-(undecanoyl)-asparagine
LM ID
LMFA0805A087
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
300.204908
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)
XTEZFKMYWPYZSV-LBPRGKRZSA-N
InChi (Click to copy)
InChI=1S/C15H28N2O4/c1-2-3-4-5-6-7-8-9-10-14(19)17-12(15(20)21)11-13(16)18/h12H,2-11H2,1H3,(H2,16,18)(H,17,19)(H,20,21)/t12-/m0/s1
SMILES (Click to copy)
CCCCCCCCCCC(=N[C@@H](CC(=N)O)C(=O)O)O