Analyte Name

Azithromycin 11,12-Hydrogen Borate

Molecular Formula

C38 H71 B N2 O13

Molecular Weight

774.787

Accurate Mass

774.505

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](OC3O[C@H](C)C[C@@H]([C@@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@H]4OB(O)O[C@]14C

InChI

InChI=1S/C38H71BN2O13/c1-15-27-38(10)33(53-39(46)54-38)24(6)41(13)19-20(2)17-36(8,45)32(52-35-29(42)26(40(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)31(43)25(7)49-28/h20-33,35,42-43,45-46H,15-19H2,1-14H3/t20-,21-,22+,23-,24-,25+,26+,27+,28+,29+,30+,31+,32-,33-,35?,36-,37-,38-/m1/s1

IUPAC

(1S,2S,5R,6S,7S,8R,9R,11R,14R,15R)-8-[(3S,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-9,17-dihydroxy-6-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-1,5,7,9,11,13,14-heptamethyl-3,16,18-trioxa-13-aza-17-borabicyclo[13.3.0]octadecan-4-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat