In-Silico Structure Database (LMISSD)
Common Name
Ala 14:1(9Z)
Systematic Name
N-(9Z-tetradecenoyl)-alanine
LM ID
LMFA0805A006
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
297.230394
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)
OYVLSMMNLIZUJX-XHPSBEMXSA-N
InChi (Click to copy)
InChI=1S/C17H31NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16(19)18-15(2)17(20)21/h6-7,15H,3-5,8-14H2,1-2H3,(H,18,19)(H,20,21)/b7-6-/t15-/m0/s1
SMILES (Click to copy)
CCCC/C=C\CCCCCCCC(=N[C@@H](C)C(=O)O)O