{(1S,2R,4aS,6S,8aS)-6-{[6-Deoxy-α-L-mannopyranosyl-(1->2)-[6-deoxy-α-L-mannopyranosyl-(1->4)]-β-D-glucopyranosyl]oxy}-2-[(2R,3S,3aS,4S,5S,5'R,6aS)-4-hydroxy-3,4,5'-trimethyldecahydrospiro[c yclopenta[b]furan-2,2'-pyran]-5-yl]-8a-methyldecahydro-1-naphthalenyl}acetic acid

More details:

• Systematic name

  {(1S,2R,4aS,6S,8aS)-6-{[6-Deoxy-alpha-L-mannopyranosyl-(1->2)-[6-deoxy-alpha-L-mannopyranosyl-(1->4)]-beta-D-glucopyranosyl]oxy}-2-[(2R,3S,3aS,4S,5S,5'R,6aS)-4-hydroxy-3,4,5'-trimethyldecahydrospiro[c yclopenta[b]furan-2,2'-pyran]-5-yl]-8a-methyldecahydro-1-naphthalenyl}acetic acid

• SMILES

  C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@H]([C@]3(C)O)[C@@H]4CC[C@H]5C[C@H](CC[C@@]5([C@H]4CC(=O)O)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@@H]([C@H]([C@@H](O7)C)O)O)O)O)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)C)OC1

• Std. InChi

  InChI=1S/C45H74O19/c1-18-9-12-45(57-17-18)19(2)30-27(64-45)14-26(44(30,6)56)24-8-7-22-13-23(10-11-43(22,5)25(24)15-29(47)48)60-42-39(63-41-36(54)34(52)32(50)21(4)59-41)37(55)38(28(16-46)61-42)62-40-35(53)33(51)31(49)20(3)58-40/h18-28,30-42,46,49-56H,7-17H2,1-6H3,(H,47,48)/t18-,19+,20+,21+,22+,23+,24-,25+,26+,27+,28-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1

• Std. InChIKey

  VFKLYFUEZQORTR-WMIZRKRRSA-N

• Cite this record

  CSID:28509132, http://www.chemspider.com/Chemical-Structure.28509132.html (accessed 05:20, Apr 20, 2024)