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Substance Name: 9-Acetylmidecamycin
RN: 35457-78-4
InChIKey: YKKSEPVQMRNIJV-CCGCOWOLSA-N

Molecular Formula

  • C43-H69-N-O16

Molecular Weight

  • 856.0091
 
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Names and Synonyms

Name of Substance

  • 9-Acetylmidecamycin

Systematic Name

  • Leucomycin V, 9-acetate 3,4(B)-dipropanoate

Registry Numbers

CAS Registry Number

  • 35457-78-4

System Generated Number

  • 0035457784

Structure Descriptors

InChI

1S/C43H69NO16/c1-12-32(47)57-31-22-34(49)53-25(4)17-15-14-16-18-30(56-28(7)46)24(3)21-29(19-20-45)39(40(31)52-11)60-42-37(50)36(44(9)10)38(26(5)55-42)59-35-23-43(8,51)41(27(6)54-35)58-33(48)13-2/h14-16,18,20,24-27,29-31,35-42,50-51H,12-13,17,19,21-23H2,1-11H3/b15-14+,18-16+/t24-,25-,26-,27+,29+,30+,31-,35+,36-,37-,38-,39+,40+,41+,42+,43-/m1/s1

InChIKey

YKKSEPVQMRNIJV-CCGCOWOLSA-N

Smiles

CCC(=O)O[C@@H]1CC(=O)O[C@@H](C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]1OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)CC)(C)O)N(C)C)O)CC=O)C)OC(=O)C)C