化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4,12,15-triacetyloxy-9-[(E)-5-(4-苯甲酰基苯基)五-4-enoyl]氧基-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-13-烯-2-基]苯甲酸 [(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4,12,15-triacetyloxy-9-[(E)-5-(4-benzoylphenyl)pent-4-enoyl]oxy-10,14,20,20-tetramethyl-11,18-dioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C52H52O16/c1-28-39-42(63-30(3)54)44(58)50(7)36(64-38(56)21-15-14-16-32-22-24-34(25-23-32)40(57)33-17-10-8-11-18-33)26-37-51(27-61-37,67-31(4)55)43(50)46(65-47(59)35-19-12-9-13-20-35)52(49(39,5)6)45(66-48(60)68-52)41(28)62-29(2)53/h8-14,16-20,22-25,36-37,41-43,45-46H,15,21,26-27H2,1-7H3/b16-14+/t36-,37+,41+,42+,43-,45-,46-,50+,51-,52+/m0/s1

InChI Key

RCNNWAZYQYBBCW-MSKZNOFGSA-N

Canonical SMILES

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

别名