(1β,3β,5β,22R)-3-{[6-Deoxy-4-O-(β-D-glucopyranosyl)-β-D-gulopyranosyl]oxy}-26-(α-D-galactopyranosyloxy)-22-hydroxyfurost-25(27)-en-1-yl 6-deoxy-4-O-(6-deoxy-β-D-gulopyranosyl)-be ta-D-allopyranoside

More details:

• Systematic name

  (1beta,3beta,5beta,22R)-3-{[6-Deoxy-4-O-(beta-D-glucopyranosyl)-beta-D-gulopyranosyl]oxy}-26-(alpha-D-galactopyranosyloxy)-22-hydroxyfurost-25(27)-en-1-yl 6-deoxy-4-O-(6-deoxy-beta-D-gulopyranosyl)-be ta-D-allopyranoside

• SMILES

  C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC[C@H]5[C@@]4([C@@H](C[C@@H](C5)O[C@H]6[C@@H]([C@@H]([C@H]([C@H](O6)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O[C@H]8[C@@H]([C@@H]([C@@H]([C@H](O8)C)O[C@H]9[C@@H]([C@@H]([C@H]([C@H](O9)C)O)O)O)O)O)C)C)O[C@@]1(CCC(=C)CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O

• Std. InChi

  InChI=1S/C57H94O27/c1-20(19-74-50-43(68)39(64)36(61)31(17-58)79-50)10-13-57(73)21(2)34-30(84-57)16-29-27-9-8-25-14-26(78-51-46(71)41(66)49(23(4)76-51)83-54-45(70)40(65)37(62)32(18-59)80-54)15-33(56(25,7)28(27)11-12-55(29,34)6)81-52-47(72)42(67)48(24(5)77-52)82-53-44(69)38(63)35(60)22(3)75-53/h21-54,58-73H,1,8-19H2,2-7H3/t21-,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+,49-,50-,51-,52-,53-,54-,55-,56-,57+/m0/s1

• Std. InChIKey

  PSJVJZYSECBFHJ-LDJYXWTRSA-N

• Cite this record

  CSID:23009971, http://www.chemspider.com/Chemical-Structure.23009971.html (accessed 13:30, Apr 19, 2024)