(1S,3R,4R,5S,6S,7R,10S,12R,13S,15R,16R,17S,18S,19R,22S,24R,25R,26R,28R,29R)-16-{[(2R,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-p yran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-12,24-bis(hydroxymethyl)-2,9,11,14,21,23,27,30-octaoxapentacyclo[20.2.2.2^10,13.1^3,7.1^15,19]triacontane-4,5,6,17,18,25,26,28,29-nonol (non-preferred na me)

More details:

• Systematic name

  (1S,3R,4R,5S,6S,7R,10S,12R,13S,15R,16R,17S,18S,19R,22S,24R,25R,26R,28R,29R)-16-{[(2R,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-p yran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-12,24-bis(hydroxymethyl)-2,9,11,14,21,23,27,30-octaoxapentacyclo[20.2.2.2~10,13~.1~3,7~.1~15,19~]triacontane-4,5,6,17,18,25,26,28,29-nonol (non-preferred na me)

• SMILES

  C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)OC[C@@H]4[C@H]([C@@H]([C@H]([C@H](O4)O[C@@H]5[C@H](O[C@H](O1)[C@@H]([C@H]5O)O)CO)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)CO)O)O)O

• Std. InChi

  InChI=1S/C36H60O30/c37-1-7-13(41)17(45)23(51)33(57-7)65-29-19(47)14(42)8(2-38)58-35(29)66-30-20(48)16(44)12-6-56-31-25(53)21(49)27(9(3-39)59-31)63-34-24(52)18(46)15(43)11(61-34)5-55-32-26(54)22(50)28(10(4-40)60-32)64-36(30)62-12/h7-54H,1-6H2/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16-,17+,18+,19+,20+,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33-,34-,35-,36-/m1/s1

• Std. InChIKey

  VJSYDCRNVLFHEZ-OUQMXBNDSA-N

• Cite this record

  CSID:17590867, http://www.chemspider.com/Chemical-Structure.17590867.html (accessed 03:59, Apr 24, 2024)