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COA COO

Fidaxomicin Impurity 4

Impurity

CAS Number

106008-69-9

Molecular Formula

C52H74Cl2O18

Product format

Neat

Molecular Weight

1058.05

API Family

Fidaxomicin

Synonyms

(2R, 3S, 4S, 5S, 6R)-6-(((3E, 5E, 8S, 9E, 11S, 12R, 13E, 15E, 18S)-12-(((2R, 3S, 4S, 5S)-3, 5-dihydroxy-4-(isobutyryloxy)-6, 6-dimethyltetrahydro-2H-pyran-2-yl)oxy)-11-ethyl-8-hydroxy-18-((R)-1-hydroxyethyl)-9, 13, 15-trimethyl-2-oxooxacyclooctadeca-3, 5, 9, 13, 15-pentaen-3-yl)methoxy)-4-hydroxy-5-methoxy-2-methyltetrahydro-2H-pyran-3-yl 3, 5-dichloro-2-ethyl-4 and 6-dihydroxybenzoate

Iupac Name

[6-[[(3Z, 5E, 9E, 13E, 15E)-12-[3, 5-dihydroxy-6, 6-dimethyl-4-(2-methylpropanoyloxy)oxan-2-yl]oxy-11-ethyl-8-hydroxy-18-(1-hydroxyethyl)-9, 13, 15-trimethyl-2-oxo-1-oxacyclooctadeca-3, 5, 9, 13, 15-pentaen-3-yl]methoxy]-4-hydroxy-5-methoxy-2-methyloxan-3-yl] 3, 5-dichloro-2-ethyl-4 and 6-dihydroxybenzoate

InChI

InChI=1S/C52H74Cl2O18/c1-13-30-22-26(6)33(56)18-16-15-17-31(23-66-51-45(65-12)40(59)43(29(9)67-51)69-49(64)35-32(14-2)36(53)39(58)37(54)38(35)57)48(63)68-34(28(8)55)20-19-25(5)21-27(7)42(30)71-50-41(60)44(70-47(62)24(3)4)46(61)52(10,11)72-50/h15-17,19,21-22,24,28-30,33-34,40-46,50-51,55-61H,13-14,18,20,23H2,1-12H3/b16-15+,25-19+,26-22+,27-21+,31-17-

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COA COO

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Synthesis

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