1-O-[(3β)-3-{[6-Deoxy-4-O-(β-D-glucopyranosyl)-β-D-galactopyranosyl]oxy}-27-hydroxy-27,28-dioxoolean-12-en-28-yl]-β-D-glucopyranose

More details:

• Systematic name

  1-O-[(3beta)-3-{[6-Deoxy-4-O-(beta-D-glucopyranosyl)-beta-D-galactopyranosyl]oxy}-27-hydroxy-27,28-dioxoolean-12-en-28-yl]-beta-D-glucopyranose

• SMILES

  O=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]83[C@H](/C2=C/C[C@H]7[C@](C)([C@]2(C(=O)O)CC3)CC[C@@H]6[C@]7(C)CC[C@H](O[C@@H]5O[C@@H]([C@H](O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO)[C@H](O)[C@H]5O)C)C6(C)C)CC(C)(C)CC8

• Std. InChi

  InChI=1S/C48H76O19/c1-21-37(66-39-34(56)31(53)29(51)24(19-49)63-39)33(55)36(58)38(62-21)65-28-11-12-45(6)26(44(28,4)5)10-13-46(7)27(45)9-8-22-23-18-43(2,3)14-15-47(23,16-17-48(22,46)41(59)60)42(61)67-40-35(57)32(54)30(52)25(20-50)64-40/h8,21,23-40,49-58H,9-20H2,1-7H3,(H,59,60)/t21-,23+,24-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-,36-,37+,38+,39+,40+,45+,46-,47+,48-/m1/s1

• Std. InChIKey

  VYHYYPSTYRXLPO-BFHXCZLFSA-N

• Cite this record

  CSID:9518552, http://www.chemspider.com/Chemical-Structure.9518552.html (accessed 15:34, May 17, 2024)