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]4-甲氧基苯羧酸 [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] 4-methoxybenzoate

InChI

InChI=1S/C51H52O17/c1-27-39-41(63-29(3)53)43(56)49(7)36(65-38(55)23-16-31-14-19-35(20-15-31)64-46(57)33-17-21-34(59-8)22-18-33)24-37-50(26-61-37,67-30(4)54)42(49)45(60-25-32-12-10-9-11-13-32)51(48(39,5)6)44(66-47(58)68-51)40(27)62-28(2)52/h9-23,36-37,40-42,44-45H,24-26H2,1-8H3/b23-16+/t36-,37+,40+,41+,42-,44-,45-,49+,50-,51+/m0/s1

InChI Key

HSXGKBFOCARZDU-AVCSWDKDSA-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=CC=C(C=C8)OC)C)OC(=O)C

别名

• CHEMBL266446