化学式

CAS号

IUPAC Name

[(1R,2R,5R,6S,7S,8R,9R,11R,12E,13S,14R)-12-[(E)-3-(2-氨基吡啶-3-基)丙-2-enoxy]亚氨基-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-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)-12-[(E)-3-(2-aminopyridin-3-yl)prop-2-enoxy]imino-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-3,15,17-trioxabicyclo[12.3.0]heptadecan-6-yl] 2-pyridin-2-ylacetate

InChI

InChI=1S/C46H67N5O12/c1-12-34-46(8)40(62-44(55)63-46)28(4)36(50-57-22-16-18-31-17-15-21-49-41(31)47)26(2)25-45(7,56-11)39(61-43-37(53)33(51(9)10)23-27(3)58-43)29(5)38(30(6)42(54)59-34)60-35(52)24-32-19-13-14-20-48-32/h13-21,26-30,33-34,37-40,43,53H,12,22-25H2,1-11H3,(H2,47,49)/b18-16+,50-36+/t26-,27-,28+,29+,30-,33+,34-,37-,38+,39-,40-,43+,45-,46-/m1/s1

InChI Key

ARAKWFNWCZWKTC-RLLUKFIUSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOCC=CC3=C(N=CC=C3)N)C(CC(C(C(C(C(C(=O)O1)C)OC(=O)CC4=CC=CC=N4)C)OC5C(C(CC(O5)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL3612628