化学式

CAS号

IUPAC Name

1-环丙基-6-[(E)-3-[[(1R,2R,5S,7R,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-5-氟-12-甲氧基亚氨基-1,5,7,9,11,13-六甲基-4,6,16-三氧代-3,15,17-trioxabicyclo[12.3.0]十七烷-9-基]氧基]丙-1-烯基]-4-羟基-3-羧酸 1-cyclopropyl-6-[(E)-3-[[(1R,2R,5S,7R,8R,9R,11R,12E,13S,14R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-5-fluoro-12-methoxyimino-1,5,7,9,11,13-hexamethyl-4,6,16-trioxo-3,15,17-trioxabicyclo[12.3.0]heptadecan-9-yl]oxy]prop-1-enyl]-4-oxoquinoline-3-carboxylic acid

InChI

InChI=1S/C47H64FN3O14/c1-12-34-47(8)40(64-44(58)65-47)26(4)35(49-59-11)24(2)22-45(6,60-19-13-14-28-15-18-32-30(21-28)36(52)31(41(55)56)23-51(32)29-16-17-29)39(27(5)38(54)46(7,48)43(57)62-34)63-42-37(53)33(50(9)10)20-25(3)61-42/h13-15,18,21,23-27,29,33-34,37,39-40,42,53H,12,16-17,19-20,22H2,1-11H3,(H,55,56)/b14-13+,49-35+/t24-,25-,26+,27+,33+,34-,37-,39-,40-,42+,45-,46+,47-/m1/s1

InChI Key

NIQLLMJVUCFILV-NVDPDRAZSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOC)C(CC(C(C(C(=O)C(C(=O)O1)(C)F)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OCC=CC4=CC5=C(C=C4)N(C=C(C5=O)C(=O)O)C6CC6)C)C)OC(=O)O2)C

别名

• CHEMBL4468094