2,3-bis(3,7,11,15,19-pentamethylicosoxy)propyl [(1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-cyclohexoxy] hydrogen phosphate

More details:

• Systematic name

  2,3-bis(3,7,11,15,19-pentamethylicosoxy)propyl [(1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-cyclohexoxy] hydrogen phosphate

• SMILES

  CC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCOCC(COP(=O)(O)OO[C@H]1[C@@H]([C@H]([C@@H]([C@H]([C@H]1O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O)OCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)C

• Std. InChi

  InChI=1S/C65H129O17P/c1-44(2)21-13-23-46(5)25-15-27-48(7)29-17-31-50(9)33-19-35-52(11)37-39-76-42-54(77-40-38-53(12)36-20-34-51(10)32-18-30-49(8)28-16-26-47(6)24-14-22-45(3)4)43-78-83(74,75)82-81-64-61(72)59(70)58(69)60(71)63(64)80-65-62(73)57(68)56(67)55(41-66)79-65/h44-73H,13-43H2,1-12H3,(H,74,75)/t46?,47?,48?,49?,50?,51?,52?,53?,54?,55-,56-,57+,58+,59+,60-,61-,62-,63-,64+,65-/m1/s1

• Std. InChIKey

  PAKGULHXDOBBMI-MTXWPYGLSA-N

• Cite this record

  CSID:29273190, http://www.chemspider.com/Chemical-Structure.29273190.html (accessed 08:40, Apr 25, 2024)