β-Ala-Lys-AMCA   Click here for help

GtoPdb Ligand ID: 9501

Synonyms: β-alanyl-lysyl-N-7-amino-4-methylcoumarin-3-acetic acid | Beta-Ala-Lys-N(epsilon)-AMCA
 Ligand is labelled
Compound class: Peptide
Comment: A fluorescent dipeptide.
2D Structure
Click here for help
Click here for structure editor
SMILES / InChI / InChIKey
Click here for help
Canonical SMILES NCCC(=O)NC(C(=O)O)CCCCNC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)N
Isomeric SMILES NCCC(=O)N[C@H](C(=O)O)CCCCNC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)N
InChI InChI=1S/C21H28N4O6/c1-12-14-6-5-13(23)10-17(14)31-21(30)15(12)11-19(27)24-9-3-2-4-16(20(28)29)25-18(26)7-8-22/h5-6,10,16H,2-4,7-9,11,22-23H2,1H3,(H,24,27)(H,25,26)(H,28,29)/t16-/m0/s1
InChI Key BXZFTTVQAOLWHY-INIZCTEOSA-N
Classification Click here for help
Compound class Peptide
IUPAC Name Click here for help
(2S)-6-[[2-(7-amino-4-methyl-2-oxochromen-3-yl)acetyl]amino]-2-(3-aminopropanoylamino)hexanoic acid
Synonyms Click here for help
β-alanyl-lysyl-N-7-amino-4-methylcoumarin-3-acetic acid | Beta-Ala-Lys-N(epsilon)-AMCA
Database Links Click here for help
GtoPdb PubChem SID 329968440
PubChem CID 86289883
Search Google for chemical match using the InChIKey BXZFTTVQAOLWHY-INIZCTEOSA-N
Search Google for chemicals with the same backbone BXZFTTVQAOLWHY
UniChem Compound Search for chemical match using the InChIKey BXZFTTVQAOLWHY-INIZCTEOSA-N
UniChem Connectivity Search for chemical match using the InChIKey BXZFTTVQAOLWHY-INIZCTEOSA-N