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Substance Name: 6-O-Stearoyl-N-acetylmuramyl-alpha-aminobutyryl-isoglutamine
RN: 92627-93-5
InChIKey: NRIMATJNXRMBEV-UHFFFAOYSA-N

Note

  • Lipophilic muramyl dipeptide analog.

Molecular Formula

  • C38-H68-N4-O12

Molecular Weight

  • 772.971
 
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Names and Synonyms

Name of Substance

  • 6-O-Stearoyl-N-acetylmuramyl-alpha-aminobutyryl-isoglutamine

Synonym

  • Samabig

Systematic Name

  • D-alpha-Glutamine, N-(N-acetyl-6-O-(1-oxooctadecyl)muramoyl)-L-alpha-aminobutyryl-

Registry Numbers

CAS Registry Number

  • 92627-93-5

System Generated Number

  • 0092627935

Structure Descriptors

InChI

1S/C38H68N4O12/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-33(48)53-25-31(45)34(49)35(30(24-43)40-27(4)44)54-26(3)37(51)41-28(6-2)38(52)42-29(36(39)50)22-23-32(46)47/h24,26,28-31,34-35,45,49H,5-23,25H2,1-4H3,(H2,39,50)(H,40,44)(H,41,51)(H,42,52)(H,46,47)

InChIKey

NRIMATJNXRMBEV-UHFFFAOYSA-N

Smiles

C(CCCCCCCCCCCCCCCC)C(OC[C@@H]([C@@H]([C@@H]([C@@H](C=O)NC(C)=O)O[C@@H](C(N[C@@H](CC)C(=O)N[C@@H](C(N)=O)CCC(O)=O)=O)C)O)O)=O