(3β)-3-Hydroxyolean-12-en-28-oic acid dihydrate

More details:

• Systematic name

  (3beta)-3-Hydroxyolean-12-en-28-oic acid dihydrate

• SMILES

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

• Std. InChi

  InChI=1S/C30H48O3.2H2O/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7;;/h8,20-23,31H,9-18H2,1-7H3,(H,32,33);2*1H2/t20-,21-,22+,23-,27-,28+,29+,30-;;/m0../s1

• Std. InChIKey

  NZQIXFRGWXNLSP-IDYUENATSA-N

• Cite this record

  CSID:35293909, http://www.chemspider.com/Chemical-Structure.35293909.html (accessed 17:41, May 2, 2024)