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Substance Name: LL-BM 123
RN: 52932-62-4
InChIKey: PCABPYAXRZVJKF-UHFFFAOYSA-N

Note

  • Myo-inosamine containing antibiotic.

Molecular Weight

  • 811.795
 
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Names and Synonyms

Name of Substance

  • LL-BM 123

Synonyms

  • Antibiotic LL-BM 123alpha
  • D-myo-Inositol, O-2-(((S)-2-amino-5-((aminoiminomethyl)amino)-1-oxopentyl)amino)-2-deoxy-alpha-D-glucopyranosyl-(1->4)-O-alpha-D-mannopyranosyl-(1->4)-2-((((S)-5-amino-3,4-dihydro-2H-pyrrol-2-yl)carbonyl)amino)-2-deoxy-, 5-carbamate
  • LL-BM-123
  • LL-BM-123alpha

Systematic Name

  • D-myo-Inositol, O-2-(((S)-2-amino-5-((aminoiminomethyl)amino)-1-oxopentyl)amino)-2-deoxy-alpha-D-glucopyranosyl-(1-4)-O-beta-D-mannopyranosyl-(1-4)-2-((((S)-5-amino-3,4-dihydro-2H-pyrrol-2-yl)carbonyl)amino)-2-deoxy-, 5-carbamate

Registry Numbers

CAS Registry Number

  • 52932-62-4

System Generated Number

  • 0052932624

Structure Descriptors

InChI

1S/C30H53N9O17/c31-8(2-1-5-36-29(33)34)25(49)39-14-17(44)15(42)10(6-40)52-27(14)54-22-11(7-41)53-28(21(48)20(22)47)55-23-18(45)13(16(43)19(46)24(23)56-30(35)51)38-26(50)9-3-4-12(32)37-9/h8-11,13-24,27-28,40-48H,1-7,31H2,(H2,32,37)(H2,35,51)(H,38,50)(H,39,49)(H4,33,34,36)

InChIKey

PCABPYAXRZVJKF-UHFFFAOYSA-N

Smiles

N([C@@H]1[C@@H](O)[C@@H]([C@@H](OC(=O)N)[C@@H]([C@@H]1O)O)O[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1NC([C@@H](CCCNC(N)=N)N)=O)O)O)CO)O)O)C([C@@H]1N=C(CC1)N)=O