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Substance Name: Milbemycin B, 28-deoxy-6,28-epoxy-25-ethyl-, (6R,25R)-
RN: 51596-13-5
InChIKey: SEYJRKYSPOJXIB-GSQYPKHESA-N

Molecular Formula

  • C33-H48-O7

Molecular Weight

  • 556.7352
 
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Names and Synonyms

Synonym

  • (6R,25R)-28-Deoxy-6,28-epoxy-25-ethylmilbemycin B

Systematic Name

  • Milbemycin B, 28-deoxy-6,28-epoxy-25-ethyl-, (6R,25R)-

Registry Numbers

CAS Registry Number

  • 51596-13-5

System Generated Number

  • 0051596135

Structure Descriptors

InChI

1S/C33H48O7/c1-7-28-22(4)13-14-32(40-28)18-26-17-25(39-32)12-11-21(3)15-20(2)9-8-10-24-19-37-30-29(36-6)23(5)16-27(31(34)38-26)33(24,30)35/h8-11,16,20,22,25-30,35H,7,12-15,17-19H2,1-6H3/b9-8+,21-11+,24-10+/t20-,22-,25+,26-,27-,28+,29+,30+,32+,33+/m0/s1

InChIKey

SEYJRKYSPOJXIB-GSQYPKHESA-N

Smiles

CC[C@@H]1[C@H](CC[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/C[C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5OC)C)C(=O)O3)O)C)\C)C