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Clarithromycin-[13C,d3]

General Information
Catalog: BLP-003500
CAS: 959119-22-3
Molecular Formula: C37[13C]H66D3NO13
Molecular Weight: 751.96
Chemical Structure
Clarithromycin-[13C,d3]
Description Clarithromycin-[13C,d3], is the labelled analogue of Clarithromycin. Clarithromycin is an antibiotic used to treat various bacterial infections.
Synonyms Clarithromycin 13C D3
IUPAC Name (3R,4S,5S,6R,9R,11R,12R,13S,14R)-14-ethyl-12,13-dihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-[methyl(trideuterio(1-13C)methyl)amino]oxan-2-yl]oxy-7-methoxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Related CAS 81103-11-9 (unlabelled)
Canonical SMILES CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OC)C)C)O)(C)O
InChI InChI=1S/C38H69NO13/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,47-14)33(52-35-29(41)25(39(11)12)16-20(3)48-35)22(5)30(23(6)34(44)50-26)51-27-18-36(8,46-13)32(43)24(7)49-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3/t19-,20-,21+,22+,23-,24+,25+,26-,27+,29-,30+,31-,32+,33-,35+,36-,37?,38-/m1/s1/i11+1D3
InChI Key AGOYDEPGAOXOCK-KBVMJYODSA-N
Melting Point >136°C (dec.)
Purity 96% (CP); 98% atom D; 98% atom 13C
Solubility Soluble in Chloroform, Methanol
Appearance White to Off-white Solid
Storage Store at -20°C, under inert atmosphere

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