N-Nitroso-Desmethyl Clarithromycin

Analyte Name

N-Nitroso-Desmethyl Clarithromycin

Molecular Formula

C37 H66 N2 O14

Molecular Weight

762.925

Accurate Mass

762.451

SMILES

CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)N=O)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)OC

InChI

InChI=1S/C37H66N2O14/c1-14-25-37(10,45)30(42)20(4)27(40)18(2)16-36(9,48-13)32(53-34-28(41)24(39(11)38-46)15-19(3)49-34)21(5)29(22(6)33(44)51-25)52-26-17-35(8,47-12)31(43)23(7)50-26/h18-26,28-32,34,41-43,45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1

IUPAC

N-[(2S,3R,4S,6R)-2-[[(3R,4S,5S,6R,7R,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-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-3-hydroxy-6-methyloxan-4-yl]-N-methylnitrous amide

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Clarithromycin

Purity

>95% (HPLC)