(3β)-3-[(3-Carboxypropanoyl)oxy]-11-oxo(2,2,3,9,12-²H₅)olean-12-en-30-oic acid

More details:

• Systematic name

  (3beta)-3-[(3-Carboxypropanoyl)oxy]-11-oxo(2,2,3,9,12-~2~H_5_)olean-12-en-30-oic acid

• SMILES

  [2H]C1([2H])C[C@@]2(C)[C@@H](CC[C@@]3(C)[C@]4(C)CC[C@@]5(C)CC[C@@](C)(C[C@H]5C4=C([2H])C(=O)[C@@]32[2H])C(O)=O)C(C)(C)[C@@]1([2H])OC(=O)CCC(O)=O

• Std. InChi

  InChI=1S/C34H50O7/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40)/t21-,23-,24-,27+,30+,31-,32-,33+,34+/m0/s1/i11D2,18D,24D,27D

• Std. InChIKey

  OBZHEBDUNPOCJG-QMYGNVRZSA-N

• Cite this record

  CSID:107449717, http://www.chemspider.com/Chemical-Structure.107449717.html (accessed 18:42, May 13, 2024)