(3β,5α,9ξ,12β)-3-{[D-Glucopyranosyl-(1->4)-(4ξ)-3-O-acetyl-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4ξ)-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4ξ)-2,6-dideoxy-D-erythro-hexopyran osyl]oxy}-12,14-dihydroxycard-20(22)-enolide

More details:

• Systematic name

  (3beta,5alpha,9xi,12beta)-3-{[D-Glucopyranosyl-(1->4)-(4xi)-3-O-acetyl-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4xi)-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4xi)-2,6-dideoxy-D-erythro-hexopyran osyl]oxy}-12,14-dihydroxycard-20(22)-enolide

• SMILES

  C[C@@H]1C([C@H](CC(O1)O[C@H]2CC[C@]3([C@H](C2)CC[C@@H]4C3C[C@H]([C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)OC7C[C@@H](C([C@H](O7)C)OC8C[C@@H](C([C@H](O8)C)OC9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)OC(=O)C)O

• Std. InChi

  InChI=1S/C49H76O20/c1-21-43(67-38-17-32(53)44(22(2)62-38)68-39-18-33(64-24(4)51)45(23(3)63-39)69-46-42(58)41(57)40(56)34(19-50)66-46)31(52)16-37(61-21)65-27-9-11-47(5)26(14-27)7-8-29-30(47)15-35(54)48(6)28(10-12-49(29,48)59)25-13-36(55)60-20-25/h13,21-23,26-35,37-46,50,52-54,56-59H,7-12,14-20H2,1-6H3/t21-,22-,23-,26+,27+,28-,29-,30?,31+,32+,33+,34-,35-,37?,38?,39?,40-,41+,42-,43?,44?,45?,46?,47+,48+,49+/m1/s1

• Std. InChIKey

  JAYAGJDXJIDEKI-RMDWMKDYSA-N

• Cite this record

  CSID:17467177, http://www.chemspider.com/Chemical-Structure.17467177.html (accessed 16:35, Apr 30, 2024)