化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R)-4,12-二乙酰-9-羟基-15-[(2R,3S)-2-羟基-2-甲基-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-10,14,20,20-四甲基-11,18-二氧代-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)-4,12-diacetyloxy-9-hydroxy-15-[(2R,3S)-2-hydroxy-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,20,20-tetramethyl-11,18-dioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C47H55NO17/c1-23-30-32(59-24(2)49)35(52)44(9)28(51)21-29-46(22-58-29,63-25(3)50)33(44)37(61-38(53)27-19-15-12-16-20-27)47(43(30,7)8)36(62-41(56)65-47)31(23)60-39(54)45(10,57)34(26-17-13-11-14-18-26)48-40(55)64-42(4,5)6/h11-20,28-29,31-34,36-37,51,57H,21-22H2,1-10H3,(H,48,55)/t28-,29+,31+,32+,33-,34-,36?,37-,44+,45+,46-,47+/m0/s1

InChI Key

JKZIICVYJYAAMS-SHFAFNCBSA-N

Canonical SMILES

CC1=C2C(C(=O)C3(C(CC4C(C3C(C5(C2(C)C)C(C1OC(=O)C(C)(C(C6=CC=CC=C6)NC(=O)OC(C)(C)C)O)OC(=O)O5)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C

别名