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COA COO

Mono-Methylated Fidaxomicin

Impurity

CAS Number

2987177-46-6

Molecular Formula

C53H76Cl2O18

Product format

Neat

Molecular Weight

1072.07

API Family

Fidaxomicin

Synonyms

(2R, 3S, 4S, 5S, 6R)-6-(((3E, 5E, 8S, 9E, 11S, 12R, 13E, 15E, 18S)-12-(((2R, 3S, 4R, 5S)-3, 4-dihydroxy-5-(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 and 5-dichloro-2-ethyl-6-hydroxy-4-methoxybenzoate

Iupac Name

[(2R, 3S, 4S, 5S, 6R)-6-[[(3E, 5Z, 8S, 9E, 11S, 13E, 15E, 18S)-12-[(2R, 3S, 4R, 5S)-3, 4-dihydroxy-6, 6-dimethyl-5-(2-methylpropanoyloxy)oxan-2-yl]oxy-11-ethyl-8-hydroxy-18-[(1R)-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 and 5-dichloro-2-ethyl-6-hydroxy-4-methoxybenzoate

InChI

InChI=1S/C53H76Cl2O18/c1-14-31-23-27(6)34(57)19-17-16-18-32(24-67-52-46(66-13)42(61)44(30(9)68-52)70-50(64)36-33(15-2)37(54)45(65-12)38(55)39(36)58)49(63)69-35(29(8)56)21-20-26(5)22-28(7)43(31)71-51-41(60)40(59)47(53(10,11)73-51)72-48(62)25(3)4/h16-18,20,22-23,25,29-31,34-35,40-44,46-47,51-52,56-61H,14-15,19,21,24H2,1-13H3/b17-16-,26-20+,27-23+,28-22+,32-18+/t29-,30-,31+,34+,35+,40-,41+,42+,43?,44-,46+,47+,51-,52-/m1/s1

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COA COO

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Synthesis

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