化学式

CAS号

IUPAC Name

[4-[(E)-3-氧代-3-[[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4,12,15-triacetyloxy-10,14,20,20-四甲基-11,18-二氧代-2-苄氧基-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-9-基]氧基]丙-1-烯基]苯基]1H-吲哚-2-甲酸基酯 [4-[(E)-3-oxo-3-[[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4,12,15-triacetyloxy-10,14,20,20-tetramethyl-11,18-dioxo-2-phenylmethoxy-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-9-yl]oxy]prop-1-enyl]phenyl] 1H-indole-2-carboxylate

InChI

InChI=1S/C52H51NO16/c1-27-40-42(64-29(3)55)44(58)50(7)37(66-39(57)22-19-31-17-20-34(21-18-31)65-47(59)36-23-33-15-11-12-16-35(33)53-36)24-38-51(26-62-38,68-30(4)56)43(50)46(61-25-32-13-9-8-10-14-32)52(49(40,5)6)45(67-48(60)69-52)41(27)63-28(2)54/h8-23,37-38,41-43,45-46,53H,24-26H2,1-7H3/b22-19+/t37-,38+,41+,42+,43-,45-,46-,50+,51-,52+/m0/s1

InChI Key

BVOOXCJHGRUXPH-WNXKNGSISA-N

Canonical SMILES

CC1=C2C(C(=O)C3(C(CC4C(C3C(C5(C2(C)C)C(C1OC(=O)C)OC(=O)O5)OCC6=CC=CC=C6)(CO4)OC(=O)C)OC(=O)C=CC7=CC=C(C=C7)OC(=O)C8=CC9=CC=CC=C9N8)C)OC(=O)C

别名

• CHEMBL267901