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Substance Name: VM 44864
RN: 115008-94-1
InChIKey: GECMPKVUETUUQS-IDMUAULZSA-N

Note

  • Metabolite of milbemycin; from Streptomyces E225.

Molecular Weight

  • 598.772
 
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Names and Synonyms

Name of Substance

  • VM 44864

Synonym

  • VM-44864

Systematic Name

  • Milbemycin B, 28-deoxy-6,28-epoxy-22-hydroxy-25-(1-methyl-1-propenyl)-, (6R,22R,25S(E))-

Registry Numbers

CAS Registry Number

  • 115008-94-1

System Generated Number

  • 0115008941

Structure Descriptors

InChI

1S/C35H50O8/c1-8-22(4)30-24(6)16-29(36)34(43-30)18-27-17-26(42-34)13-12-21(3)14-20(2)10-9-11-25-19-40-32-31(39-7)23(5)15-28(33(37)41-27)35(25,32)38/h8-12,15,20,24,26-32,36,38H,13-14,16-19H2,1-7H3/b10-9+,21-12+,22-8+,25-11+/t20-,24-,26+,27-,28?,29+,30+,31+,32+,34-,35+/m0/s1

InChIKey

GECMPKVUETUUQS-IDMUAULZSA-N

Smiles

O[C@H]1[C@]2(C[C@@H]3C[C@H](O2)CC=C(C[C@H](C=CC=C2[C@@]4([C@H](OC2)[C@@H](C(=C[C@@H]4C(O3)=O)C)OC)O)C)C)O[C@@H]([C@H](C1)C)\C(C)=C\C