 Home > Encyclopedia > dimethyl (2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]pentanedioate

dimethyl (2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]pentanedioate

dimethyl (2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]pentanedioate structure

CAS No:
60355-79-5
Formula:
C21H35N3O12
Chemical Name:
dimethyl (2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]pentanedioate
Synonyms:
dimethyl-N-acetylmuramyl-alanylglutamate;dimethyl-N-acetylmuramyl-L-alanyl-D-glutamate;dimethyl-N-AcMu-Ala-Glu;N-acetylmuramyl-L-alanyl-D-glutamic acid dimethyl ester;Dimethyl-N-acmu-ala-glu;Dimethyl-N-acetylmuramyl-alanylglutamate;N-Acetylmuramyl-L-alanyl-D-glutamic acid dimethyl ester;Dimethyl-N-acetylmuramyl-L-alanyl-D-glutamate;D-Glutamic acid, N-(N-(N-acetylmuramoyl)-L-alanyl)-, dimethyl ester;60355-79-5

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dimethyl (2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]pentanedioate Basic Attributes

Molecular Weight：

521.5 g/mol

Exact Mass：

521.22207356 g/mol

Characteristics

PSA：

219 Å²

Drug Information

MeSH Entry Terms：

dimethyl-N-acetylmuramyl-alanylglutamate

Computed Properties

Molecular Weight:521.5
XLogP3:-2.4
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:14
Exact Mass:521.22207356
Monoisotopic Mass:521.22207356
Topological Polar Surface Area:219
Heavy Atom Count:36
Complexity:794
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of dimethyl (2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]pentanedioate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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