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Substance Name: UK 80695
RN: 127346-86-5
InChIKey: XQJPRIJOJVJRFC-VYLBHDSBSA-N

Note

  • Shows potent nematicidal activity; isolated from Streptomyces hygroscopicus; member of milbemycin family.

Molecular Formula

  • C38-H54-O9

Molecular Weight

  • 654.836
 
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Names and Synonyms

Name of Substance

  • UK 80695

Synonym

  • UK-80695

Systematic Name

  • Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)-

Registry Numbers

CAS Registry Number

  • 127346-86-5

System Generated Number

  • 0127346865

Structure Descriptors

InChI

1S/C38H54O9/c1-9-22(4)33-25(7)15-16-37(47-33)19-29-18-28(46-37)14-13-24(6)32(45-35(40)21(2)3)23(5)11-10-12-27-20-43-34-31(39)26(8)17-30(36(41)44-29)38(27,34)42/h9-13,17,21,23,25,28-34,39,42H,14-16,18-20H2,1-8H3/b11-10+,22-9+,24-13+,27-12+/t23-,25-,28+,29-,30?,31+,32?,33+,34+,37+,38+/m0/s1

InChIKey

XQJPRIJOJVJRFC-VYLBHDSBSA-N

Smiles

C1C[C@]2(C[C@@H]3C[C@H](CC=C([C@@H](OC(C(C)C)=O)[C@H](C=CC=C4[C@@]5([C@H](OC4)[C@@H](C(=C[C@@H]5C(O3)=O)C)O)O)C)C)O2)O[C@@H](\C(C)=C\C)[C@H]1C