化学式

CAS号

IUPAC Name

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-氧代-1H-喹啉-3-羧酸 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-oxo-1H-quinoline-3-carboxylic acid

InChI

InChI=1S/C44H60FN3O14/c1-12-31-44(8)37(61-41(55)62-44)24(4)32(47-56-11)22(2)20-42(6,57-17-13-14-26-15-16-29-27(19-26)33(49)28(21-46-29)38(52)53)36(25(5)35(51)43(7,45)40(54)59-31)60-39-34(50)30(48(9)10)18-23(3)58-39/h13-16,19,21-25,30-31,34,36-37,39,50H,12,17-18,20H2,1-11H3,(H,46,49)(H,52,53)/b14-13+,47-32+/t22-,23-,24+,25+,30+,31-,34-,36-,37-,39+,42-,43+,44-/m1/s1

InChI Key

OGRRRXJNPBDNSE-FSUJTERLSA-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)NC=C(C5=O)C(=O)O)C)C)OC(=O)O2)C

别名

• CHEMBL4451718