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Substance Name: Sdz mrl 953
RN: 123136-61-8
InChIKey: DRYNWBQTTUKLQD-STUKOUKJSA-N

Note

  • Monosaccharide lipid A analog which has improved activity in experimental sepsis.

Molecular Formula

  • C48-H92-N-O14-P

Molecular Weight

  • 938.222
 
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Names and Synonyms

Name of Substance

  • Sdz mrl 953

Synonyms

  • 2-Deoxy-3,4-bis-O-(3-hydroxytetradecanoyl)-2-(3-hydroxytetradecanoylamido)-1-O-phosphono-alpha-D-glucopyranose
  • Sdz mrl-953

Systematic Name

  • alpha-D-Glucopyranose, 2-deoxy-2-((3-hydroxy-1-oxotetradecyl)amino)-, 1-(dihydrogen phosphate) 3,4-bis(3-hydroxytetradecanoate), (2(R),3(R),4(R))-

Registry Numbers

CAS Registry Number

  • 123136-61-8

System Generated Number

  • 0123136618

Structure Descriptors

InChI

1S/C48H92NO14P/c1-4-7-10-13-16-19-22-25-28-31-38(51)34-42(54)49-45-47(62-44(56)36-40(53)33-30-27-24-21-18-15-12-9-6-3)46(41(37-50)60-48(45)63-64(57,58)59)61-43(55)35-39(52)32-29-26-23-20-17-14-11-8-5-2/h38-41,45-48,50-53H,4-37H2,1-3H3,(H,49,54)(H2,57,58,59)/t38-,39-,40-,41-,45-,46-,47-,48-/m1/s1

InChIKey

DRYNWBQTTUKLQD-STUKOUKJSA-N

Smiles

O1[C@@H]([C@@H](OC(=O)C[C@H](O)CCCCCCCCCCC)[C@H](OC(C[C@@H](CCCCCCCCCCC)O)=O)[C@H]([C@H]1OP(=O)(O)O)NC(=O)C[C@H](O)CCCCCCCCCCC)CO