19-DEFORMYL-4'-DEOXYDESMYCOSIN

85382-79-2

MFCD00883734

C38 H65 N O12

727.927

InChI=1S/C38H65NO12/c1-12-30-26(19-47-38-36(46-11)35(45-10)32(43)25(7)49-38)15-20(2)13-14-28(40)21(3)16-22(4)34(24(6)29(41)18-31(42)50-30)51-37-33(44)27(39(8)9)17-23(5)48-37/h13-15,21-27,29-30,32-38,41,43-44H,12,16-19H2,1-11H3/b14-13+,20-15+/t21-,22+,23-,24+,25-,26-,27+,29-,30-,32-,33-,34+,35-,36-,37+,38-/m1/s1

InChIKey=MMHPQRIORHAXGA-PRAYNDSJSA-N

CC[C@@H]1[C@H](/C=C(/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)C)C)\C)CO[C@H]3[C@@H]([C@@H]([C@@H]([C@H](O3)C)O)OC)OC

pro_donors:3

pro_acceptors:13

XLogP3:3.0

Bulk/Fine:F