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-1,5,7,9,11,13-六甲基-4,16-二氧代-12-[(E)-3-[5-[(2-吡啶-2-ylacetyl)氨基]吡啶-3-基]丙-2-enoxy]亚氨基-3,15,17-trioxabicyclo[12.3.0]十七烷-6-基]2-吡啶-2-乙酸乙酯 [(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-1,5,7,9,11,13-hexamethyl-4,16-dioxo-12-[(E)-3-[5-[(2-pyridin-2-ylacetyl)amino]pyridin-3-yl]prop-2-enoxy]imino-3,15,17-trioxabicyclo[12.3.0]heptadecan-6-yl] 2-pyridin-2-ylacetate

InChI

InChI=1S/C53H72N6O13/c1-12-41-53(8)48(71-51(64)72-53)33(4)44(58-66-23-17-18-36-25-39(30-54-29-36)57-42(60)26-37-19-13-15-21-55-37)31(2)28-52(7,65-11)47(70-50-45(62)40(59(9)10)24-32(3)67-50)34(5)46(35(6)49(63)68-41)69-43(61)27-38-20-14-16-22-56-38/h13-22,25,29-35,40-41,45-48,50,62H,12,23-24,26-28H2,1-11H3,(H,57,60)/b18-17+,58-44+/t31-,32-,33+,34+,35-,40+,41-,45-,46+,47-,48-,50+,52-,53-/m1/s1

InChI Key

IAWLLRHDUBZZGD-IUTQABSQSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOCC=CC3=CC(=CN=C3)NC(=O)CC4=CC=CC=N4)C(CC(C(C(C(C(C(=O)O1)C)OC(=O)CC5=CC=CC=N5)C)OC6C(C(CC(O6)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL3612630