N-acetyl-muramoyl-(L-alanyl-γ-D-glutamyl-L-lysyl-D-alanine)

Chemical Formula:

C₂₈H₄₇N₆O₁₄

Molecular Weight:

691.711 Daltons

Monoisotopic Mass:

693.3306753135 Daltons

SMILES:

CC(NC(C(C)OC1(C(NC(C)=O)C(OC(CO)C(O)1)O))=O)C(NC(C([O-])=O)CCC(NC(CCCC[N+])C(NC(C)C([O-])=O)=O)=O)=O

InChI:

1S/C28H48N6O14/c1-12(30-24(40)14(3)47-22-20(32-15(4)36)28(46)48-18(11-35)21(22)38)23(39)34-17(27(44)45)8-9-19(37)33-16(7-5-6-10-29)25(41)31-13(2)26(42)43/h12-14,16-18,20-22,28,35,38,46H,5-11,29H2,1-4H3,(H,30,40)(H,31,41)(H,32,36)(H,33,37)(H,34,39)(H,42,43)(H,44,45)/p-1/t12-,13+,14+,16-,17+,18+,20+,21+,22+,28?/m0/s1

InChIKey:

KJVAVFINNPJDHE-SJQUVFAWSA-M

Synonyms

NAM-(L-Ala-D-isoGlu-L-Lys-D-Ala
NAM-tetrapeptide

Databases

MetaCyc: CPD-20757

PubChem (CID): 134820295