化学式

CAS号

IUPAC Name

[(Z)-[(1R,2R,5R,7R,8R,9R,11R,13S,14R)-8-[(2S,3R,4R,5S,6R)-4-(二甲基氨基)-3-羟基-5-苄氧基-6-(苄氧基甲基)四氢吡喃-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,4R,5S,6R)-4-(dimethylamino)-3-hydroxy-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-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/C52H68N2O14/c1-11-39-52(7)46(66-50(59)67-52)32(3)40(53-68-48(58)37-25-19-14-20-26-37)31(2)27-51(6,60-10)45(33(4)42(55)34(5)47(57)64-39)65-49-43(56)41(54(8)9)44(62-29-36-23-17-13-18-24-36)38(63-49)30-61-28-35-21-15-12-16-22-35/h12-26,31-34,38-39,41,43-46,49,56H,11,27-30H2,1-10H3/b53-40-/t31-,32+,33+,34-,38-,39-,41-,43-,44-,45-,46-,49+,51-,52-/m1/s1

InChI Key

IIBVMRRCWRAUJY-BDVIEEODSA-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)COCC5=CC=CC=C5)OCC6=CC=CC=C6)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• J3.559.837E
• 9-[(E)-(Benzoyloxy)imino]-9-deoxo-5-[[4-O,6-O-dibenzyl-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