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Substance Name: Diacetylspiramycin III
RN: 99664-83-2
InChIKey: REDHZNLPLQBCCV-LBFPBFSLSA-N

Note

  • Component of acetylspiramycin.

Molecular Weight

  • 983.195
 
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Names and Synonyms

  • Diacetylspiramycin III

Registry Numbers

CAS Registry Number

  • 99664-83-2

System Generated Number

  • 0099664832

Structure Descriptors

InChI

1S/C50H82N2O17/c1-13-38(56)66-37-26-39(57)62-28(2)17-15-14-16-18-36(67-40-25-33(19-22-53)42(51(8)9)30(4)63-40)29(3)34(20-23-54)35(21-24-55)46(47(37)61-12)69-49-44(58)43(52(10)11)45(31(5)65-49)68-41-27-50(7,60)48(59)32(6)64-41/h14-16,18,22-24,28-37,40-49,58-60H,13,17,19-21,25-27H2,1-12H3/b15-14+,18-16+/t28-,29-,30-,31-,32+,33?,34?,35+,36+,37-,40+,41+,42-,43-,44-,45-,46+,47+,48+,49+,50-/m1/s1

InChIKey

REDHZNLPLQBCCV-LBFPBFSLSA-N

Smiles

C(C[C@@H]1C[C@@H](O[C@@H]([C@H]1N(C)C)C)O[C@H]1C=CC=CC[C@H](OC(C[C@@H](OC(=O)CC)[C@@H]([C@H]([C@H]([C@@H]([C@H]1C)CC=O)CC=O)O[C@H]1[C@@H]([C@@H](N(C)C)[C@@H]([C@H](O1)C)O[C@H]1C[C@](C)([C@H]([C@@H](C)O1)O)O)O)OC)=O)C)=O