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Substance Name: N-Acetyl-beta-glucosaminyl-N-acetylmuramyl-alanylisoglutamine
RN: 70280-03-4
InChIKey: JPBBNLWRCVBGJS-KCAUTNRHSA-N

Classification Codes

  • Adjuvants, Immunologic
  • Immunologic Factors

Molecular Formula

  • C27-H45-N5-O16

Molecular Weight

  • 695.672
 
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Names and Synonyms

Name of Substance

  • N-Acetyl-beta-glucosaminyl-N-acetylmuramyl-alanylisoglutamine

Synonyms

  • Acetylglucosaminyl-amaig
  • D-alpha-Glutamine, N2-(N-(2-(acetylamino)-4-O-(2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl)-2-deoxymuramoyl)-L-alanyl)-
  • Glcnac-amaig
  • N-Acetyl-beta-D-glucosaminyl-N-acetylmuramyl-L-alanyl-D-isoglutamine
  • N-Acetyl-beta-glucosaminyl-N-acetylmuramyl dipeptide
  • N-Acetyl-beta-glucosaminyl-N-acmu-ala-iso-gln
  • N-Acetylglucosaminyl (beta1-4) acetylmuramyl-L-alanyl-D-isoglutamine
  • N-Acetylglucosaminyl (beta1-4)-muramyl dipeptide
  • N-Acetylglucosaminyl-mdp

Systematic Name

  • D-alpha-Glutamine, N2-(N-(N-acetyl-4-O-(2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl)muramoyl)-L-alanyl)-

Registry Numbers

CAS Registry Number

  • 70280-03-4

System Generated Number

  • 0070280034

Structure Descriptors

InChI

1S/C27H45N5O16/c1-10(25(44)32-14(24(28)43)5-6-18(39)40)29-26(45)11(2)46-22(15(7-33)30-12(3)36)23(16(38)8-34)48-27-19(31-13(4)37)21(42)20(41)17(9-35)47-27/h7,10-11,14-17,19-23,27,34-35,38,41-42H,5-6,8-9H2,1-4H3,(H2,28,43)(H,29,45)(H,30,36)(H,31,37)(H,32,44)(H,39,40)/t10-,11+,14+,15-,16+,17+,19+,20+,21+,22+,23+,27-/m0/s1

InChIKey

JPBBNLWRCVBGJS-KCAUTNRHSA-N

Smiles

O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)NC(=O)C)O[C@@H]([C@H](O[C@@H](C(N[C@H](C(N[C@@H](C(=O)N)CCC(=O)O)=O)C)=O)C)[C@@H](NC(=O)C)C=O)[C@H](O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
human TDLo oral 6mg/kg/21D-I (6mg/kg) BLOOD: "CHANGES IN SERUM COMPOSITION (E.G., TP, BILIRUBIN, CHOLESTEROL)"

MUSCULOSKELETAL: OTHER CHANGES
Lancet. Vol. 352, Pg. 1857, 1998.