化学式

CAS号

IUPAC Name

[(2S,3R,4S,7R,9S,10S,15R,16S)-4,12-二乙酰-15-[(2R)-3-(3,3-dimethylbutanoylamino)-2-羟基-5-methylhexanoyl]氧基-9-羟基-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-12-烯-2-基]苯甲酸 [(2S,3R,4S,7R,9S,10S,15R,16S)-4,12-diacetyloxy-15-[(2R)-3-(3,3-dimethylbutanoylamino)-2-hydroxy-5-methylhexanoyl]oxy-9-hydroxy-10,14,20,20-tetramethyl-11,18-dioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-12-en-2-yl] benzoate

InChI

InChI=1S/C45H59NO16/c1-21(2)17-26(46-29(50)19-41(6,7)8)31(51)39(54)58-32-22(3)30-33(57-23(4)47)35(52)43(11)27(49)18-28-44(20-56-28,61-24(5)48)34(43)37(59-38(53)25-15-13-12-14-16-25)45(42(30,9)10)36(32)60-40(55)62-45/h12-16,21-22,26-28,31-32,34,36-37,49,51H,17-20H2,1-11H3,(H,46,50)/t22?,26?,27-,28+,31+,32+,34-,36-,37-,43+,44-,45?/m0/s1

InChI Key

WBMOESYMSHZWES-FUDCQWIOSA-N

Canonical SMILES

CC1C(C2C3(C(C4C(C(CC5C4(CO5)OC(=O)C)O)(C(=O)C(=C1C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)OC(=O)O2)OC(=O)C(C(CC(C)C)NC(=O)CC(C)(C)C)O

别名