化学式

CAS号

IUPAC Name

[(2S,3R,4S,7R,9S,11R,13R,16R,17S)-4,13-二乙酰-16-[(2R,3S)-2-羟基-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-15,21,21-三甲基-12,19-二氧代-6,18,20-trioxahexacyclo[12.6.1.01,17.03,11.04,7.09,11]henicos-14-烯-2-基]苯甲酸 [(2S,3R,4S,7R,9S,11R,13R,16R,17S)-4,13-diacetyloxy-16-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-15,21,21-trimethyl-12,19-dioxo-6,18,20-trioxahexacyclo[12.6.1.01,17.03,11.04,7.09,11]henicos-14-en-2-yl] benzoate

InChI

InChI=1S/C46H51NO16/c1-22-29-33(57-23(2)48)35(51)44-20-27(44)19-28-45(21-56-28,61-24(3)49)34(44)37(59-38(52)26-17-13-10-14-18-26)46(43(29,7)8)36(60-41(55)63-46)32(22)58-39(53)31(50)30(25-15-11-9-12-16-25)47-40(54)62-42(4,5)6/h9-18,27-28,30-34,36-37,50H,19-21H2,1-8H3,(H,47,54)/t27-,28-,30+,31-,32-,33-,34+,36+,37+,44-,45+,46?/m1/s1

InChI Key

HXZQYVQXHPNLLC-CZXKMNMLSA-N

Canonical SMILES

CC1=C2C(C(=O)C34CC3CC5C(C4C(C6(C2(C)C)C(C1OC(=O)C(C(C7=CC=CC=C7)NC(=O)OC(C)(C)C)O)OC(=O)O6)OC(=O)C8=CC=CC=C8)(CO5)OC(=O)C)OC(=O)C

别名