In-Silico Structure Database (LMISSD)
Common Name
Arg 17:0
Systematic Name
N-(heptadecanoyl)-arginine
LM ID
LMFA0805A052
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
412.341341
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)
LEIFGVZEHILHNX-IBGZPJMESA-N
InChi (Click to copy)
InChI=1S/C22H44N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(27)26-19(21(28)29)17-18-25-22(23)24/h19H,2-18H2,1H3,(H,26,27)(H,28,29)(H4,23,24,25)/t19-/m0/s1
SMILES (Click to copy)
CCCCCCCCCCCCCCCCC(=N[C@@H](CCNC(=N)N)C(=O)O)O