(1S,3S,5R,6S,8S,10R,11S,13S,15R,16S,18S,20R,21S,23S,25R,26S,28S,30R,31S,33S,35S,36R,37R,38S,39S,40S,41S,42S,43S,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30,35-Heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19 ,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.2^3,6.2^8,11.2^13,16.2^18,21.2^23,26.2^28,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol (non-preferred name)

SMILES:

O1[C@H](CO)[C@H]2O[C@@H]8O[C@@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@H]1[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]4O)[C@H](O)[C@H]5O)[C@H](O)[C@H]6O)[C@H](O)[C@H]7O)[C@H](O)[C@H]8O CopyCopied

Std. InChI:

InChI=1S/C42H70O35/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51/h8-63H,1-7H2/t8-,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+,37+,38+,39+,40+,41+,42+/m1/s1 CopyCopied

Std. InChIKey:

WHGYBXFWUBPSRW-DJFZDUSPSA-N CopyCopied

CSID:13183693, http://www.chemspider.com/Chemical-Structure.13183693.html (accessed 22:38, May 23, 2012) CopyCopied