(3β,5α,9ξ,12β)-3-{[β-D-Glucopyranosyl-(1->4)-(4ξ)-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4ξ)-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4ξ)-2,6-dideoxy-β-D-erythro-hexopyrano syl]oxy}-12,14-dihydroxycard-20(22)-enolide

More details:

• Systematic name

  (3beta,5alpha,9xi,12beta)-3-{[beta-D-Glucopyranosyl-(1->4)-(4xi)-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4xi)-2,6-dideoxy-D-erythro-hexopyranosyl-(1->4)-(4xi)-2,6-dideoxy-beta-D-erythro-hexopyrano syl]oxy}-12,14-dihydroxycard-20(22)-enolide

• SMILES

  C[C@@H]1C([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@H](C2)CC[C@@H]4C3C[C@H]([C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)OC7C[C@@H](C([C@H](O7)C)OC8C[C@@H](C([C@H](O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O)O

• Std. InChi

  InChI=1S/C47H74O19/c1-20-41(64-36-16-30(50)42(21(2)60-36)65-37-17-31(51)43(22(3)61-37)66-44-40(56)39(55)38(54)32(18-48)63-44)29(49)15-35(59-20)62-25-8-10-45(4)24(13-25)6-7-27-28(45)14-33(52)46(5)26(9-11-47(27,46)57)23-12-34(53)58-19-23/h12,20-22,24-33,35-44,48-52,54-57H,6-11,13-19H2,1-5H3/t20-,21-,22-,24+,25+,26-,27-,28?,29+,30+,31+,32-,33-,35+,36?,37?,38-,39+,40-,41?,42?,43?,44+,45+,46+,47+/m1/s1

• Std. InChIKey

  OBATZBGFDSVCJD-ZUIMXFRMSA-N

• Cite this record

  CSID:17466669, http://www.chemspider.com/Chemical-Structure.17466669.html (accessed 03:36, May 5, 2024)