DI METHYLATED FIDAXOMICIN
On Request
Molecular Formula
C54H78Cl2O18
Molecular Weight
1086.1000
CAS Number
185248-68-4
PubChem CID
178247541 ↗
IUPAC Name
(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 3,5-dichloro-2-ethyl-4,6-dimethoxybenzoate
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📝 Synonyms
Fidaxomicin Impurity 37
🔬 Chemical Identifiers
CC[C@H]1/C=C(/[C@H](C/C=C/C=C(/C(=O)O[C@@H](C/C=C(/C=C(/[C@@H]1O[C@H]2[C@H]([C@H]([C@@H](C(O2)(C)C)OC(=O)C(C)C)O)O)\C)\C)[C@@H](C)O)\CO[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)OC(=O)C4=C(C(=C(C(=C4OC)Cl)OC)Cl)CC)O)OC)O)\C
InChI=1S/C54H78Cl2O18/c1-15-32-24-28(6)35(58)20-18-17-19-33(25-68-53-47(67-14)42(61)44(31(9)69-53)71-51(64)37-34(16-2)38(55)46(66-13)39(56)45(37)65-12)50(63)70-36(30(8)57)22-21-27(5)23-29(7)43(32)72-52-41(60)40(59)48(54(10,11)74-52)73-49(62)26(3)4/h17-19,21,23-24,26,30-32,35-36,40-44,47-48,52-53,57-61H,15-16,20,22,25H2,1-14H3/b18-17+,27-21+,28-24+,29-23+,33-19+/t30-,31-,32+,35+,36+,40-,41+,42+,43+,44-,47+,48+,52-,53-/m1/s1
VSQXOITUBILBJL-BQHRKGTQSA-N
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