化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-乙酰氧基-15-[(2R,3S)-2-(1-乙氧基乙氧基)-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-10,14,20,20-四甲基-11,18-二氧代-9,12-双(2,2,2-trichloroethoxycarbonyloxy)-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-2-基]苯甲酸 [(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-acetyloxy-15-[(2R,3S)-2-(1-ethoxyethoxy)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,20,20-tetramethyl-11,18-dioxo-9,12-bis(2,2,2-trichloroethoxycarbonyloxy)-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C54H61Cl6NO21/c1-11-70-28(4)74-37(34(29-18-14-12-15-19-29)61-44(66)81-48(5,6)7)43(65)76-35-26(2)33-36(77-46(68)73-25-53(58,59)60)39(63)50(10)31(75-45(67)72-24-52(55,56)57)22-32-51(23-71-32,80-27(3)62)38(50)41(78-42(64)30-20-16-13-17-21-30)54(49(33,8)9)40(35)79-47(69)82-54/h12-21,28,31-32,34-38,40-41H,11,22-25H2,1-10H3,(H,61,66)/t28?,31-,32+,34-,35+,36+,37+,38-,40-,41-,50+,51-,54+/m0/s1

InChI Key

YOBXYNYUYPPRFX-KIJKTRRUSA-N

Canonical SMILES

CCOC(C)OC(C(C1=CC=CC=C1)NC(=O)OC(C)(C)C)C(=O)OC2C3C4(C(C5C(C(CC6C5(CO6)OC(=O)C)OC(=O)OCC(Cl)(Cl)Cl)(C(=O)C(C(=C2C)C4(C)C)OC(=O)OCC(Cl)(Cl)Cl)C)OC(=O)C7=CC=CC=C7)OC(=O)O3

别名