化学式

CAS号

IUPAC Name

[(Z)-[(1R,2R,5R,7R,8R,9R,11R,13S,14R)-8-[(2S,3R,4S,5S,6R)-4-(二甲基氨基)-3,5-二羟基-6-(甲氧基甲基)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,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-(methoxymethyl)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/C39H58N2O14/c1-12-26-39(7)33(53-37(47)54-39)21(3)27(40-55-35(46)24-16-14-13-15-17-24)20(2)18-38(6,49-11)32(22(4)29(42)23(5)34(45)51-26)52-36-31(44)28(41(8)9)30(43)25(50-36)19-48-10/h13-17,20-23,25-26,28,30-33,36,43-44H,12,18-19H2,1-11H3/b40-27-/t20-,21+,22+,23-,25-,26-,28+,30-,31-,32-,33-,36+,38-,39-/m1/s1

InChI Key

BWMLZZHKKDBRKO-HLOMDWFISA-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)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• J3.559.834K
• 9-[(E)-(Benzoyloxy)imino]-9-deoxo-5-[[6-O-methyl-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