N-Acetylmuramyl-L-Alanyl-D-Isoglutamine-6-O-Stearoyl
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N-Acetylmuramyl-L-Alanyl-D-Isoglutamine-6-O-Stearoyl

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N-Acetylmuramyl-L-Alanyl-D-Isoglutamine-6-O-Stearoyl acts as a NOD2 receptor agonist. It showed a higher activity than unmodified MDP.

Category
Peptide Inhibitors
Catalog number
BAT-015853
CAS number
60398-08-5
Molecular Formula
C37H66N4O12
Molecular Weight
758.94
N-Acetylmuramyl-L-Alanyl-D-Isoglutamine-6-O-Stearoyl
IUPAC Name
(4R)-4-[[(2S)-2-[[(2R)-2-[(3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(octadecanoyloxymethyl)oxan-4-yl]oxypropanoyl]amino]propanoyl]amino]-5-amino-5-oxopentanoic acid
Synonyms
Ac-(6-O-stearoyl)-muramyl-Ala-D-Glu-NH2; 6-O-Stearoyl-N-acetylmuramyl-alanylisoglutamine; D-alpha-Glutamine, N2-(N-(N-acetyl-6-O-(1-oxooctadecyl)muramoyl)-L-alanyl)-
Appearance
White Powder
Purity
>99%
Density
1.2±0.1 g/cm3
Boiling Point
1018.5±65.0 °C at 760 mmHg
InChI
InChI=1S/C37H66N4O12/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30(45)51-23-28-32(46)33(31(37(50)53-28)40-26(4)42)52-25(3)36(49)39-24(2)35(48)41-27(34(38)47)21-22-29(43)44/h24-25,27-28,31-33,37,46,50H,5-23H2,1-4H3,(H2,38,47)(H,39,49)(H,40,42)(H,41,48)(H,43,44)/t24-,25+,27+,28+,31+,32+,33+,37?/m0/s1
InChI Key
DWCYDOMADJBCEO-HOJOVNGYSA-N
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)O)NC(=O)C)OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)N)O
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