In-Silico Structure Database (LMISSD)
Common Name
Arg 22:6(4Z,7Z,10Z,13Z,16Z,19Z)
Systematic Name
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-arginine
LM ID
LMFA0805A075
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
470.325691
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)
CBRFHYKQDOALEM-PJEZTNATSA-N
InChi (Click to copy)
InChI=1S/C27H42N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(32)31-24(26(33)34)22-23-30-27(28)29/h3-4,6-7,9-10,12-13,15-16,18-19,24H,2,5,8,11,14,17,20-23H2,1H3,(H,31,32)(H,33,34)(H4,28,29,30)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-/t24-/m0/s1
SMILES (Click to copy)
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=N[C@@H](CCNC(=N)N)C(=O)O)O