(4E)-5-[(2S,3aR,5R,5'R,6R,6''R,7aR)-2-{(R)-Hydroxy[(2R,5S,6S)-2-hydroxy-5-methyl-6-{3-[(1'R,2S,2'R,3S,5R,6'R,8'S,10'S)-3,5,10'-trimethyl-8'H-spiro[piperidine-2,4'-[3,7,12]trioxatricyclo[6.3.1.0^2,6]d odecan]-8'-yl]-1-propen-2-yl}tetrahydro-2H-pyran-2-yl]methyl}-4'',6-dimethyl-2,3,3',3'',3a,4',6,6'',7,7a-decahydrodispiro[furo[3,2-b]pyran-5,2'-furan-5',2''-pyran]-6''-yl]-4-pentenoic acid

More details:

• Systematic name

  (4E)-5-[(2S,3aR,5R,5'R,6R,6''R,7aR)-2-{(R)-Hydroxy[(2R,5S,6S)-2-hydroxy-5-methyl-6-{3-[(1'R,2S,2'R,3S,5R,6'R,8'S,10'S)-3,5,10'-trimethyl-8'H-spiro[piperidine-2,4'-[3,7,12]trioxatricyclo[6.3.1.0~2,6~]d odecan]-8'-yl]-1-propen-2-yl}tetrahydro-2H-pyran-2-yl]methyl}-4'',6-dimethyl-2,3,3',3'',3a,4',6,6'',7,7a-decahydrodispiro[furo[3,2-b]pyran-5,2'-furan-5',2''-pyran]-6''-yl]-4-pentenoic acid

• SMILES

  C[C@H]1CC[C@@](O[C@@H]1C(=C)C[C@@]23C[C@H](C[C@@H](O2)[C@@H]4[C@H](O3)C[C@]5(O4)[C@H](C[C@H](CN5)C)C)C)([C@@H]([C@@H]6C[C@@H]7[C@H](O6)C[C@H]([C@@]8(O7)CC[C@@]9(O8)CC(=C[C@H](O9)/C=C/CCC(=O)O)C)C)O)O

• Std. InChi

  InChI=1S/C47H71NO12/c1-26-17-33(10-8-9-11-39(49)50)54-43(21-26)14-15-47(60-43)32(7)19-34-35(57-47)20-37(53-34)42(51)46(52)13-12-29(4)40(59-46)30(5)23-44-22-27(2)18-36(55-44)41-38(56-44)24-45(58-41)31(6)16-28(3)25-48-45/h8,10,17,27-29,31-38,40-42,48,51-52H,5,9,11-16,18-25H2,1-4,6-7H3,(H,49,50)/b10-8+/t27-,28+,29-,31-,32+,33+,34+,35+,36+,37-,38+,40-,41+,42+,43+,44-,45-,46+,47+/m0/s1

• Std. InChIKey

  NQIYMIINGTZTOC-SJSMKAIBSA-N

• Cite this record

  CSID:29214823, http://www.chemspider.com/Chemical-Structure.29214823.html (accessed 21:25, Apr 19, 2024)