Erythromycin(114-07-8) MS
Molecular FormulaC37H67NO13
Molecular Weight733.93
InChIInChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1
InChIKey ULGZDMOVFRHVEP-RWJQBGPGSA-N
Smiles[C@]1([C@H](OC([C@@H]([C@H]([C@H](C)[C@H]([C@@](O)(C)C[C@@H](C)C([C@H](C)[C@H]1O)=O)O[C@@H]1O[C@@H](C[C@@H]([C@H]1O)N(C)C)C)O[C@@H]1O[C@@H](C)[C@H](O)[C@](OC)(C1)C)C)=O)CC)(C)O