(2β,3β,16α)-3-(β-D-Glucopyranosyloxy)-2,16,23-trihydroxyolean-12-en-28-oic acid

More details:

• Systematic name

  (2beta,3beta,16alpha)-3-(beta-D-Glucopyranosyloxy)-2,16,23-trihydroxyolean-12-en-28-oic acid

• SMILES

  C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)(C[C@@H]([C@@H]([C@@]3(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)C

• Std. InChi

  InChI=1S/C36H58O11/c1-31(2)11-12-36(30(44)45)19(13-31)18-7-8-23-32(3)14-20(39)28(47-29-27(43)26(42)25(41)21(16-37)46-29)33(4,17-38)22(32)9-10-34(23,5)35(18,6)15-24(36)40/h7,19-29,37-43H,8-17H2,1-6H3,(H,44,45)/t19-,20-,21+,22+,23+,24+,25+,26-,27+,28-,29-,32-,33-,34+,35+,36+/m0/s1

• Std. InChIKey

  XFVGJHHHDVZQFB-FWVVSBQTSA-N

• Cite this record

  CSID:62958236, http://www.chemspider.com/Chemical-Structure.62958236.html (accessed 16:17, May 12, 2024)