(2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(octadecanoyloxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-amino-5-oxopentanoic acid
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(2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(octadecanoyloxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-amino-5-oxopentanoic acid
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CAS No:
60398-08-5
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Formula:
C37H66N4O12
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Chemical Name:
(2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(octadecanoyloxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-amino-5-oxopentanoic acid
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Synonyms:
6-O-stearoyl-muramyl dipeptide;6-O-stearoyl-N-acetylmuramyl-alanylisoglutamine;6-O-stearoyl-N-AcMu-Ala-iso-Gln;6-SMDP;L18-MDP(Ala);6-O-Stearoyl-N-acetylmuramyl-alanylisoglutamine;(2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(octadecanoyloxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-amino-5-oxopentanoic acid;6-Smdp;L18-Mdp(ala);6-O-Stearoyl-muramyl dipeptide;6-O-Stearoyl-N-acmu-ala-iso-gln;D-alpha-Glutamine, N2-(N-(N-acetyl-6-O-(1-oxooctadecyl)muramoyl)-L-alanyl)-;A15705
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CAS No:
(2R)-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(octadecanoyloxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-amino-5-oxopentanoic acid Basic Attributes
758.9 g/mol
758.46772355 g/mol
Computed Properties
Molecular Weight:758.9
XLogP3:4.7
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:30
Exact Mass:758.46772355
Monoisotopic Mass:758.46772355
Topological Polar Surface Area:253
Heavy Atom Count:53
Complexity:1130
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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