化学式

CAS号

IUPAC Name

[(Z)-[(1R,2R,5R,7R,8R,9R,11R,13S,14R)-8-[(2S,3R,4S,5S,6R)-6-(乙酰氧基甲基)-4-(二甲基氨基)-3,5-dihydroxyoxan-2-基]氧基-2-乙基-9-甲氧基-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-12-亚基]氨基]苯甲酸 [(Z)-[(1R,2R,5R,7R,8R,9R,11R,13S,14R)-8-[(2S,3R,4S,5S,6R)-6-(acetyloxymethyl)-4-(dimethylamino)-3,5-dihydroxyoxan-2-yl]oxy-2-ethyl-9-methoxy-1,5,7,9,11,13-hexamethyl-4,6,16-trioxo-3,15,17-trioxabicyclo[12.3.0]heptadecan-12-ylidene]amino] benzoate

InChI

InChI=1S/C40H58N2O15/c1-12-27-40(8)34(55-38(49)56-40)21(3)28(41-57-36(48)25-16-14-13-15-17-25)20(2)18-39(7,50-11)33(22(4)30(44)23(5)35(47)53-27)54-37-32(46)29(42(9)10)31(45)26(52-37)19-51-24(6)43/h13-17,20-23,26-27,29,31-34,37,45-46H,12,18-19H2,1-11H3/b41-28-/t20-,21+,22+,23-,26-,27-,29+,31-,32-,33-,34-,37+,39-,40-/m1/s1

InChI Key

ODNWIZWPRDOWFS-BKMHLBSOSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOC(=O)C3=CC=CC=C3)C(CC(C(C(C(=O)C(C(=O)O1)C)C)OC4C(C(C(C(O4)COC(=O)C)O)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• J3.559.831F
• 9-[(E)-(Benzoyloxy)imino]-9-deoxo-5-[[6-O-acetyl-3-(dimethylamino)-3-deoxy-beta-D-glucopyranosyl]oxy]-3-des(3-O,3-dimethyl-2,6-dideoxy-alpha-L-ribo-hexopyranosyloxy)-5-des[3-(dimethylamino)-3,4,6-trideoxy-beta-D-xylo-hexopyranosyloxy]-6-O-methyl-3-oxo-11-O,12-O-carbonylerythromycin