化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-乙酰氧基-12-ethylsulfanylcarbonyloxy-15-[(2R,3S)-2-羟基-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-9-甲氧基-10,14,20,20-四甲基-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,3R,4S,7R,9S,10S,12R,15R,16S)-4-acetyloxy-12-ethylsulfanylcarbonyloxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-9-methoxy-10,14,20,20-tetramethyl-11,18-dioxo-17,19-dioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C49H59NO16S/c1-11-67-44(58)61-35-31-25(2)34(60-41(55)33(52)32(27-18-14-12-15-19-27)50-42(56)65-45(4,5)6)38-49(46(31,7)8,66-43(57)63-38)39(62-40(54)28-20-16-13-17-21-28)36-47(9,37(35)53)30(59-10)24-29-22-23-48(29,36)64-26(3)51/h12-21,29-30,32-36,38-39,52H,11,22-24H2,1-10H3,(H,50,56)/t29-,30+,32+,33-,34-,35-,36+,38+,39+,47-,48+,49-/m1/s1

InChI Key

HENBZRVASOHUFP-DUWBZNQASA-N

Canonical SMILES

CCSC(=O)OC1C2=C(C(C3C(C2(C)C)(C(C4C(C1=O)(C(CC5C4(CC5)OC(=O)C)OC)C)OC(=O)C6=CC=CC=C6)OC(=O)O3)OC(=O)C(C(C7=CC=CC=C7)NC(=O)OC(C)(C)C)O)C

别名

• SCHEMBL18251615