化学式

CAS号

IUPAC Name

[(1S,2S,4S,7R,9R,10S,12R,15R,16S)-4,12-二乙酰-9-羟基-15-[(2R,3S)-2-羟基-5-甲基-3-[(2-甲基-2-基)oxycarbonylamino]hexanoyl]氧基-10,20,20-三甲基-11,18-二氧代-17,19-dioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-2-基]苯甲酸 [(1S,2S,4S,7R,9R,10S,12R,15R,16S)-4,12-diacetyloxy-9-hydroxy-15-[(2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]oxy-10,20,20-trimethyl-11,18-dioxo-17,19-dioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C44H57NO16/c1-21(2)18-27(45-38(53)60-40(5,6)7)30(49)37(52)56-28-20-26-31(55-22(3)46)33(50)42(10)29(48)19-25-16-17-43(25,59-23(4)47)32(42)35(57-36(51)24-14-12-11-13-15-24)44(41(26,8)9)34(28)58-39(54)61-44/h11-15,20-21,25,27-32,34-35,48-49H,16-19H2,1-10H3,(H,45,53)/t25-,27+,28-,29-,30-,31-,32?,34+,35+,42-,43+,44-/m1/s1

InChI Key

KYPOLRXKWQFKOA-MZEASBDUSA-N

Canonical SMILES

CC(C)CC(C(C(=O)OC1C=C2C(C(=O)C3(C(CC4CCC4(C3C(C5(C1OC(=O)O5)C2(C)C)OC(=O)C6=CC=CC=C6)OC(=O)C)O)C)OC(=O)C)O)NC(=O)OC(C)(C)C

别名