化学式

CAS号

IUPAC Name

[(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]N-(3-吡啶-3-ylprop-2-丙炔)氨基甲酯 [(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] N-(3-pyridin-3-ylprop-2-ynyl)carbamate

InChI

InChI=1S/C41H62N4O12/c1-13-30-41(8)35(56-39(49)57-41)25(4)31(44-51-12)23(2)21-40(7,50-11)34(55-37-32(46)29(45(9)10)20-24(3)52-37)26(5)33(27(6)36(47)53-30)54-38(48)43-19-15-17-28-16-14-18-42-22-28/h14,16,18,22-27,29-30,32-35,37,46H,13,19-21H2,1-12H3,(H,43,48)/b44-31+/t23-,24-,25+,26+,27-,29+,30-,32-,33+,34-,35-,37+,40-,41-/m1/s1

InChI Key

RWVKIBNTEMAINU-KNYNVIOESA-N

Canonical SMILES

CCC1C2(C(C(C(=NOC)C(CC(C(C(C(C(C(=O)O1)C)OC(=O)NCC#CC3=CN=CC=C3)C)OC4C(C(CC(O4)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL4453519