化学式

CAS号

IUPAC Name

N-[5-[3-[[(1R,2R,5R,6S,7S,8R,9R,11R,12E,13S,14R)-8-[(2S,3R,4S,6R)-4-(二甲基氨基)-3-羟基-6-methyloxan-2-基]氧基-2-乙基-9-甲氧基-12-甲氧基亚氨基-1,5,7,9,11,13-六甲基-4,16-二氧代-3,15,17-trioxabicyclo[12.3.0]十七烷-6-基]氧基]丙-1-丙炔]吡啶-2-基]吡啶-2-羧酰胺 N-[5-[3-[[(1R,2R,5R,6S,7S,8R,9R,11R,12E,13S,14R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-9-methoxy-12-methoxyimino-1,5,7,9,11,13-hexamethyl-4,16-dioxo-3,15,17-trioxabicyclo[12.3.0]heptadecan-6-yl]oxy]prop-1-ynyl]pyridin-2-yl]pyridine-2-carboxamide

InChI

InChI=1S/C46H65N5O12/c1-13-34-46(8)40(62-44(55)63-46)28(4)36(50-57-12)26(2)24-45(7,56-11)39(61-43-37(52)33(51(9)10)23-27(3)59-43)29(5)38(30(6)42(54)60-34)58-22-16-17-31-19-20-35(48-25-31)49-41(53)32-18-14-15-21-47-32/h14-15,18-21,25-30,33-34,37-40,43,52H,13,22-24H2,1-12H3,(H,48,49,53)/b50-36+/t26-,27-,28+,29+,30-,33+,34-,37-,38+,39-,40-,43+,45-,46-/m1/s1

InChI Key

FXKNHGSDGQWGHC-KIRBWRKSSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOC)C(CC(C(C(C(C(C(=O)O1)C)OCC#CC3=CN=C(C=C3)NC(=O)C4=CC=CC=N4)C)OC5C(C(CC(O5)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL4447591