化学式

CAS号

IUPAC Name

苄基[(2S,3R,4S,6R)-2-[[(1R,2S,5R,6S,7S,8R,9R,12S,13R)-2-乙基-9-[(2R)-2-羟基丙基]-6-[(2R,4R,5S,6S)-4-甲氧基-4,6-二甲基-5-phenylmethoxycarbonyloxyoxan-2-基]氧基-1,5,7,9,12-五甲基-4,11,15-三氧代-3,10,14,16-tetraoxabicyclo[11.3.0]十六-8-基]氧基]-6-甲基-4-[甲基(苄氧基羰基)氨基]四氢吡喃-3-基]碳酸酯 benzyl [(2S,3R,4S,6R)-2-[[(1R,2S,5R,6S,7S,8R,9R,12S,13R)-2-ethyl-9-[(2R)-2-hydroxypropyl]-6-[(2R,4R,5S,6S)-4-methoxy-4,6-dimethyl-5-phenylmethoxycarbonyloxyoxan-2-yl]oxy-1,5,7,9,12-pentamethyl-4,11,15-trioxo-3,10,14,16-tetraoxabicyclo[11.3.0]hexadecan-8-yl]oxy]-6-methyl-4-[methyl(phenylmethoxycarbonyl)amino]oxan-3-yl] carbonate

InChI

InChI=1S/C61H81NO21/c1-13-45-61(10)50(80-58(69)83-61)39(6)53(65)82-60(9,30-35(2)63)49(37(4)47(38(5)52(64)76-45)77-46-31-59(8,70-12)51(40(7)75-46)81-57(68)73-34-43-27-21-16-22-28-43)79-54-48(78-56(67)72-33-42-25-19-15-20-26-42)44(29-36(3)74-54)62(11)55(66)71-32-41-23-17-14-18-24-41/h14-28,35-40,44-51,54,63H,13,29-34H2,1-12H3/t35-,36-,37+,38-,39+,40+,44+,45+,46+,47+,48-,49-,50-,51+,54+,59-,60-,61-/m1/s1

InChI Key

LWQKQUSRDDAINC-GYCFYNSZSA-N

Canonical SMILES

CCC1C2(C(C(C(=O)OC(C(C(C(C(C(=O)O1)C)OC3CC(C(C(O3)C)OC(=O)OCC4=CC=CC=C4)(C)OC)C)OC5C(C(CC(O5)C)N(C)C(=O)OCC6=CC=CC=C6)OC(=O)OCC7=CC=CC=C7)(C)CC(C)O)C)OC(=O)O2)C

别名