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]3-[3-(4-咪唑-1-苯基)丙基氨基]丙酸酯 [(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] 3-[3-(4-imidazol-1-ylphenyl)propylamino]propanoate

InChI

InChI=1S/C47H73N5O12/c1-13-36-47(8)42(63-45(56)64-47)30(4)38(50-58-12)28(2)26-46(7,57-11)41(62-44-39(54)35(51(9)10)25-29(3)59-44)31(5)40(32(6)43(55)60-36)61-37(53)20-22-48-21-14-15-33-16-18-34(19-17-33)52-24-23-49-27-52/h16-19,23-24,27-32,35-36,39-42,44,48,54H,13-15,20-22,25-26H2,1-12H3/b50-38+/t28-,29-,30+,31+,32-,35+,36-,39-,40+,41-,42-,44+,46-,47-/m1/s1

InChI Key

OWRWNXOVKVMMMK-RRYSAXDXSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOC)C(CC(C(C(C(C(C(=O)O1)C)OC(=O)CCNCCCC3=CC=C(C=C3)N4C=CN=C4)C)OC5C(C(CC(O5)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL4446665