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COA COO

Fidaxomicin Metabolite OP-1118

Impurity

CAS Number

1030825-28-5

Molecular Formula

C48H68Cl2O17

Product format

Neat

Molecular Weight

987.9

Storage

-20°C

Shipping

Room Temperature

API Family

Fidaxomicin

Synonyms

J4D0XQ65KI; OPT-1118; 1030825-28-5; OP-1118; RefChem:168319; UNII-J4D0XQ65KI; (3E, 5E, 8S, 9E, 11S, 12R, 13E, 15E, 18S)-3-(((6-Deoxy-4-O-(3, 5-dichloro-2-ethyl-4, 6-dihydroxybenzoyl)-2-O-methyl-beta-L-mannopyranosyl)oxy)methyl)-12-((6-deoxy-5-C-methyl-beta-D-lyxo-hexopyranosyl)oxy)-11-ethyl-8-hydroxy-18-((1R)-1-hydroxyethyl)-9, 13, 15-tri; Fidaxomicin-Met; C48H68Cl2O17; FO71470; (3E, 5E, 8S, 9E, 11S, 12R, 13E, 15E, 18S)-3-(((6-DEOXY-4-O-(3, 5-DICHLORO-2-ETHYL-4, 6-DIHYDROXYBENZOYL)-2-O-METHYL-.BETA.-L-MANNOPYRANOSYL)OXY)METHYL)-12-((6-DEOXY-5-C-METHYL-.BETA.-D-LYXO-HEXOPYRANOSYL)OXY)-11-ETHYL-8-HYDROXY-18-((1R)-1-HYDROXYETHYL)-9, 13, 15-TRIMETHYLOXACYCLOOCTADECA-3, 5, 9, 13, 15-PENTAEN-2-ONE; [(2S, 3R, 4R, 5R, 6S)-6-[[(3E, 5E, 8S, 9E, 11S, 12R, 13E, 15E, 18S)-11-ethyl-8-hydroxy-18-[(1R)-1-hydroxyethyl]-9, 13, 15-trimethyl-2-oxo-12-[(2R, 3S, 4S, 5S)-3, 4, 5-trihydroxy-6, 6-dimethyl-tetrahydropyran-2-yl]oxy-1-oxacyclooctadeca-3, 5, 9, 13, 15-pentaen-3-yl]methoxy]-4-hydroxy-5-methoxy-2-methyl-tetrahydropyran-3-yl] 3, 5-dichloro-2-ethyl-4 and 6-dihydroxy-benzoate

Iupac Name

[(2S, 3R, 4R, 5R, 6S)-6-[[(3E, 5E, 8S, 9E, 11S, 12R, 13E, 15E, 18S)-11-ethyl-8-hydroxy-18-[(1R)-1-hydroxyethyl]-9, 13, 15-trimethyl-2-oxo-12-[(2R, 3S, 4S, 5S)-3, 4, 5-trihydroxy-6, 6-dimethyloxan-2-yl]oxy-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/C48H68Cl2O17/c1-11-27-20-23(4)30(52)16-14-13-15-28(21-62-47-42(61-10)39(57)41(26(7)63-47)65-45(60)32-29(12-2)33(49)36(54)34(50)35(32)53)44(59)64-31(25(6)51)18-17-22(3)19-24(5)40(27)66-46-38(56)37(55)43(58)48(8,9)67-46/h13-15,17,19-20,25-27,30-31,37-43,46-47,51-58H,11-12,16,18,21H2,1-10H3/b14-13+,22-17+,23-20+,24-19+,28-15+/t25-,26+,27+,30+,31+,37-,38+,39-,40+,41+,42-,43+,46-,47+/m1/s1

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COA COO

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