化学式

CAS号

IUPAC Name

[(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](E)-3-(3-苯甲酰胺基苯基)丙-2-烯酸酯 [(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] (E)-3-(3-benzamidophenyl)prop-2-enoate

InChI

InChI=1S/C50H51NO15/c1-27-38-40(62-29(3)53)42(56)48(7)35(63-37(55)22-21-31-17-14-20-34(23-31)51-45(57)33-18-12-9-13-19-33)24-36-49(26-60-36,65-30(4)54)41(48)44(59-25-32-15-10-8-11-16-32)50(47(38,5)6)43(64-46(58)66-50)39(27)61-28(2)52/h8-23,35-36,39-41,43-44H,24-26H2,1-7H3,(H,51,57)/b22-21+/t35-,36+,39+,40+,41-,43-,44-,48+,49-,50+/m0/s1

InChI Key

SHNLMCYOQHKYEX-BMXXHEOQSA-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(=CC=C7)NC(=O)C8=CC=CC=C8)C)OC(=O)C

别名

• CHEMBL195272