(1R,8R,9S,10S,11R,12R,19R,20S,21S,22R)-9,10,11,20,21,22-Hexahydroxy-3-(20-hydroxy-14-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}henicosyl)-14-(29-hydroxy-14-{[(2 R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}triacontyl)-2,6,13,17,23,24-hexaoxatricyclo[17.3.1.1^8,12]tetracosane-5,16-dione

More details:

• Systematic name

  (1R,8R,9S,10S,11R,12R,19R,20S,21S,22R)-9,10,11,20,21,22-Hexahydroxy-3-(20-hydroxy-14-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}henicosyl)-14-(29-hydroxy-14-{[(2 R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}triacontyl)-2,6,13,17,23,24-hexaoxatricyclo[17.3.1.1~8,12~]tetracosane-5,16-dione

• SMILES

  CC(CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC1CC(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(CC(=O)OC[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)O1)O)O)O)CCCCCCCCCCCCCC(CCCCCC(C)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

• Std. InChi

  InChI=1S/C81H150O28/c1-54(84)40-32-25-19-13-7-3-4-8-14-20-26-34-42-56(102-78-74(96)70(92)66(88)60(50-82)106-78)43-35-27-21-15-9-5-11-17-23-29-37-46-58-48-64(86)100-52-63-69(91)73(95)77(99)81(109-63)105-59(49-65(87)101-53-62-68(90)72(94)76(98)80(104-58)108-62)47-38-30-24-18-12-6-10-16-22-28-36-44-57(45-39-31-33-41-55(2)85)103-79-75(97)71(93)67(89)61(51-83)107-79/h54-63,66-85,88-99H,3-53H2,1-2H3/t54?,55?,56?,57?,58?,59?,60-,61-,62-,63-,66-,67-,68-,69-,70+,71+,72+,73+,74-,75-,76-,77-,78-,79-,80-,81-/m1/s1

• Std. InChIKey

  YQYKMOMCJFNBBQ-MJSFJGRCSA-N

• Cite this record

  CSID:8139562, http://www.chemspider.com/Chemical-Structure.8139562.html (accessed 03:33, Jun 4, 2024)