(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48S,49R)-5,10,15,20,25,30,35-Heptakis(hydroxymethyl)-49-{[(3S,4R,5R,6S)- 3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-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-3 6,37,38,39,40,41,42,43,44,45,46,47,48-tridec

More details:

• Systematic name

  (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48S,49R)-5,10,15,20,25,30,35-Heptakis(hydroxymethyl)-49-{[(3S,4R,5R,6S)- 3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-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-3 6,37,38,39,40,41,42,43,44,45,46,47,48-tridecol

• SMILES

  O[C@H]9[C@H](O)[C@@H](O)[C@@H](OC9O[C@@H]2[C@@H](O)[C@@H]1O[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]2O[C@@H]1CO)[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)CO

• Std. InChi

  InChI=1S/C48H80O40/c49-1-9-17(57)18(58)25(65)41(73-9)88-40-32(72)39-16(8-56)80-48(40)87-38-15(7-55)79-46(31(71)24(38)64)85-36-13(5-53)77-44(29(69)22(36)62)83-34-11(3-51)75-42(27(67)20(34)60)81-33-10(2-50)74-43(26(66)19(33)59)82-35-12(4-52)76-45(28(68)21(35)61)84-37-14(6-54)78-47(86-39)30(70)23(37)63/h9-72H,1-8H2/t9-,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+,43+,44+,45+,46+,47+,48+/m0/s1

• Std. InChIKey

  RBWGLMHXPBBZJO-BHOIPUJISA-N

• Cite this record

  CSID:9710279, http://www.chemspider.com/Chemical-Structure.9710279.html (accessed 18:24, May 6, 2024)