化学式

CAS号

IUPAC Name

[(2S,3S,4R,6R)-6-[[(1S,2R,5S,6R,7R,8S,9S,11S,14S,15S)-8-[(2R,3S,4R,6S)-4-(二甲基氨基)-3-羟基-6-methyloxan-2-基]氧基-2-乙基-9-羟基-1,5,7,9,11,13,14-庚甲基-4,17-二氧代-3,16,18-三氧杂-13-氮杂双环[13.3.0]octadecan-6-基]氧基]-4-甲氧基-2,4-dimethyloxan-3-基]N-[[(E)-3-(4-氟苯基)丙-2-enoyl]氨基]氨基甲酯 [(2S,3S,4R,6R)-6-[[(1S,2R,5S,6R,7R,8S,9S,11S,14S,15S)-8-[(2R,3S,4R,6S)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-9-hydroxy-1,5,7,9,11,13,14-heptamethyl-4,17-dioxo-3,16,18-trioxa-13-azabicyclo[13.3.0]octadecan-6-yl]oxy]-4-methoxy-2,4-dimethyloxan-3-yl] N-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]carbamate

InChI

InChI=1S/C49H77FN4O15/c1-15-35-49(10)41(68-46(59)69-49)30(6)54(13)25-26(2)23-47(8,60)40(66-44-38(56)34(53(11)12)22-27(3)62-44)28(4)39(29(5)43(57)64-35)65-37-24-48(9,61-14)42(31(7)63-37)67-45(58)52-51-36(55)21-18-32-16-19-33(50)20-17-32/h16-21,26-31,34-35,37-42,44,56,60H,15,22-25H2,1-14H3,(H,51,55)(H,52,58)/b21-18+/t26-,27-,28+,29-,30-,31-,34+,35+,37-,38-,39+,40-,41-,42-,44+,47-,48+,49-/m0/s1

InChI Key

NLESUXMYDTVCEN-PXXWLGMWSA-N

Canonical SMILES

CCC1C2(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC3CC(C(C(O3)C)OC(=O)NNC(=O)C=CC4=CC=C(C=C4)F)(C)OC)C)OC5C(C(CC(O5)C)N(C)C)O)(C)O)C)C)C)OC(=O)O2)C

别名

• CHEMBL4299410