(1R,2S,4R,5R,8R,9S,11R)-9-Formyl-2-({[(2R,3S,4S,5R,6R)-3-hydroxy-5-methoxy-6-methyl-4-({(2Z)-2-methyl-3-[(2R,2'S,3S,3'S)-3'-methyl-2,2'-bioxir-3-yl]-2-propenoyl}oxy)tetrahydro-2H-pyran-2-yl]oxy}methyl )-13-isopropyl-5-methyltetracyclo[7.4.0.0^2,11.0^4,8]tridec-12-ene-1-carboxylic acid (non-preferred name)

More details:

• Systematic name

  (1R,2S,4R,5R,8R,9S,11R)-9-Formyl-2-({[(2R,3S,4S,5R,6R)-3-hydroxy-5-methoxy-6-methyl-4-({(2Z)-2-methyl-3-[(2R,2'S,3S,3'S)-3'-methyl-2,2'-bioxir-3-yl]-2-propenoyl}oxy)tetrahydro-2H-pyran-2-yl]oxy}methyl )-13-isopropyl-5-methyltetracyclo[7.4.0.0~2,11~.0~4,8~]tridec-12-ene-1-carboxylic acid (non-preferred name)

• SMILES

  C[C@@H]1CC[C@@H]2[C@@H]1C[C@@]3([C@@H]4C[C@]2([C@]3(C(=C4)C(C)C)C(=O)O)C=O)CO[C@H]5[C@H]([C@@H]([C@@H]([C@H](O5)C)OC)OC(=O)/C(=C\[C@H]6[C@@H](O6)[C@@H]7[C@@H](O7)C)/C)O

• Std. InChi

  InChI=1S/C36H50O11/c1-16(2)24-11-21-12-34(14-37)23-9-8-17(3)22(23)13-35(21,36(24,34)33(40)41)15-43-32-26(38)30(27(42-7)19(5)45-32)47-31(39)18(4)10-25-29(46-25)28-20(6)44-28/h10-11,14,16-17,19-23,25-30,32,38H,8-9,12-13,15H2,1-7H3,(H,40,41)/b18-10-/t17-,19-,20+,21+,22-,23-,25+,26+,27-,28+,29-,30+,32-,34+,35+,36+/m1/s1

• Std. InChIKey

  UXIRHBOURWBTPC-DCNFGQQHSA-N

• Cite this record

  CSID:34486038, http://www.chemspider.com/Chemical-Structure.34486038.html (accessed 12:42, Apr 25, 2024)