(5ξ,9ξ,13ξ,16α,17ξ,18α)-16,23-Dihydroxy-13,28-epoxyolean-11-en-3-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside

More details:

• Systematic name

  (5xi,9xi,13xi,16alpha,17xi,18alpha)-16,23-Dihydroxy-13,28-epoxyolean-11-en-3-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside

• SMILES

  C[C@]12CCC(C(C1CC[C@@]3(C2C=CC45[C@]3(C[C@H](C6([C@@H]4CC(CC6)(C)C)CO5)O)C)C)(C)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O

• Std. InChi

  InChI=1S/C42H68O14/c1-36(2)13-14-41-20-53-42(25(41)15-36)12-8-24-37(3)10-9-27(38(4,19-44)23(37)7-11-39(24,5)40(42,6)16-26(41)45)56-35-33(51)31(49)29(47)22(55-35)18-52-34-32(50)30(48)28(46)21(17-43)54-34/h8,12,21-35,43-51H,7,9-11,13-20H2,1-6H3/t21-,22-,23?,24?,25+,26-,27?,28-,29-,30+,31+,32-,33-,34-,35+,37+,38?,39-,40+,41?,42?/m1/s1

• Std. InChIKey

  ACWRMVMYIHRKJI-RAWUFCCHSA-N

• Cite this record

  CSID:2301311, http://www.chemspider.com/Chemical-Structure.2301311.html (accessed 00:40, Apr 27, 2024)