(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid
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![(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/60a53d11d53b4a88a835d05d9beeb187.png "(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid")
(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid
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CAS No:
66112-58-1
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Formula:
C20H34N4O11
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Chemical Name:
(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid
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Synonyms:
Abu-MDP;aminobutyryl muramyl dipeptide;N-acetylmuramyl-aminobutyryl-isoglutamine;N-acetylmuramyl-L-alpha-aminobutyryl-D-isoglutamine;N-Acetylmuramyl-aminobutyryl-isoglutamine;(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid;66112-58-1;Abu-mdp;Aminobutyryl muramyl dipeptide;N-Acetylmuramyl-L-alpha-aminobutyryl-D-isoglutamine;D-alpha-Glutamine, Nalpha-(N-acetylmuramoyl)-L-alpha-aminobutyrl-
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CAS No:
(2R)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl-(2-aminobutanoyl)amino]-5-amino-5-oxopentanoic acid Basic Attributes
506.5 g/mol
506.22240791 g/mol
Computed Properties
Molecular Weight:506.5
XLogP3:-5.8
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:506.22240791
Monoisotopic Mass:506.22240791
Topological Polar Surface Area:252
Heavy Atom Count:35
Complexity:795
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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