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Substance Name: MM 46115
RN: 132054-37-6
InChIKey: DIYWRQBECFIIBI-GUUZMTTHSA-N

Note

  • From Actinomadura pelletieri; active against parainfluenza viruses.

Molecular Formula

  • C50-H67-Cl-N2-O10

Molecular Weight

  • 891.5363
 
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Names and Synonyms

Name of Substance

  • MM 46115

Synonyms

  • 17-O-(4-((3-Chloro-6-hydroxy-2-methylbenzoyl)amino)-2,3,4,6-tetradeoxy-3-(dimethylamino)-beta-D-lyxo-hexopyranosyl)-22-de(hydroxymethyl)-8,14,23-tridemethyl-12-ethyl-8-hydroxy-23-propylkijanolide
  • MM-46115

Systematic Name

  • Kijanolide, 17-O-(4-((3-chloro-6-hydroxy-2-methylbenzoyl)amino)-2,3,4,6-tetradeoxy-3-(dimethylamino)-beta-D-lyxo-hexopyranosyl)-22-de(hydroxymethyl)-8,14,23-tridemethyl-12-ethyl-8-hydroxy-23-propyl-

Registry Numbers

CAS Registry Number

  • 132054-37-6

System Generated Number

  • 0132054376

Structure Descriptors

InChI

1S/C50H67ClN2O10/c1-10-13-29-16-17-31-20-25(3)38(62-39-23-35(53(8)9)43(28(6)61-39)52-47(59)40-27(5)34(51)18-19-36(40)54)15-12-14-33-30(11-2)22-32-42(26(4)21-37(55)44(32)56)49(33,7)45(57)41-46(58)50(31,24-29)63-48(41)60/h12,14,16-20,22,26,28-29,31-33,35,37-39,42-44,54-56,58H,10-11,13,15,21,23-24H2,1-9H3,(H,52,59)/b14-12-,25-20-

InChIKey

DIYWRQBECFIIBI-GUUZMTTHSA-N

Smiles

CCCC1CC23C(C=C1)/C=C(/C(C/C=C\C4C(=CC5C(C4(C(=O)C(=C2O)C(=O)O3)C)C(CC(C5O)O)C)CC)OC6CC(C(C(O6)C)NC(=O)c7c(c(ccc7O)Cl)C)N(C)C)\C