[(1R,3R,5R,6R,8R,10S,11R,13R,15S,16R,18R,20S,21R,23R,25S,26R,28R,30R,31R,33R,35R,36S,37S,38S,39R,40S,41R,42S,43R,44S,45R,46S,47R,48R,49S)-20,35-Bis{[4-(allyloxy)phenoxy]methyl}-36,37,38,39,40,41,42,43 ,44,45,46,47,48,49-tetradecamethoxy-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-5,10,15,25,30-pentayl]pentame thanol

More details:

• Systematic name

  [(1R,3R,5R,6R,8R,10S,11R,13R,15S,16R,18R,20S,21R,23R,25S,26R,28R,30R,31R,33R,35R,36S,37S,38S,39R,40S,41R,42S,43R,44S,45R,46S,47R,48R,49S)-20,35-Bis{[4-(allyloxy)phenoxy]methyl}-36,37,38,39,40,41,42,43 ,44,45,46,47,48,49-tetradecamethoxy-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-5,10,15,25,30-pentayl]pentame thanol

• SMILES

  CO[C@H]1[C@H]2[C@@H](O[C@@H]([C@@H]1OC)O[C@@H]3[C@H](O[C@@H]([C@H]([C@@H]3OC)OC)O[C@@H]4[C@H](O[C@@H]([C@H]([C@H]4OC)OC)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5OC)OC)O[C@@H]6[C@@H](O[C@@H]([C@@H]([C@H]6OC)OC)O[C@@H]7[C@@H](O[C@@H]([C@@H]([C@H]7OC)OC)O[C@@H]8[C@@H](O[C@H](O2)[C@@H]([C@H]8OC)OC)CO)COc9ccc(cc9)OCC=C)CO)CO)COc1ccc(cc1)OCC=C)CO)CO

• Std. InChi

  InChI=1S/C74H114O37/c1-17-27-94-36-19-23-38(24-20-36)96-34-45-52-59(85-8)67(93-16)74(104-45)109-51-44(33-79)100-70(63(89-12)58(51)84-7)107-49-42(31-77)102-72(65(91-14)56(49)82-5)111-53-46(35-97-39-25-21-37(22-26-39)95-28-18-2)103-73(66(92-15)60(53)86-9)108-50-43(32-78)99-69(62(88-11)57(50)83-6)105-47-40(29-75)98-68(61(87-10)54(47)80-3)106-48-41(30-76)101-71(110-52)64(90-13)55(48)81-4/h17-26,40-79H,1-2,27-35H2,3-16H3/t40-,41+,42-,43-,44+,45+,46-,47+,48+,49+,50+,51+,52+,53+,54-,55+,56-,57-,58-,59-,60-,61+,62+,63+,64-,65+,66+,67-,68+,69+,70+,71+,72+,73+,74+/m0/s1

• Std. InChIKey

  CINKENNKQKVJAW-LJIFKLEWSA-N

• Cite this record

  CSID:13101578, http://www.chemspider.com/Chemical-Structure.13101578.html (accessed 12:40, Apr 24, 2024)