(3β,16β)-3-{[3-O-Methyl-β-D-glucopyranosyl-(1->3)-β-D-xylopyranosyl-(1->4)-[3-O-methyl-β-D-glucopyranosyl-(1->3)-β-D-xylopyranosyl-(1->4)-6-deoxy-β-D-glucopyranosyl-(1->2)]-β-D -xylopyranosyl]oxy}-18-oxo-18,20-epoxylanosta-9(11),25-diene-16,22-diyl diacetate

More details:

• Systematic name

  (3beta,16beta)-3-{[3-O-Methyl-beta-D-glucopyranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-[3-O-methyl-beta-D-glucopyranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-6-deoxy-beta-D-glucopyranosyl-(1->2)]-beta-D -xylopyranosyl]oxy}-18-oxo-18,20-epoxylanosta-9(11),25-diene-16,22-diyl diacetate

• SMILES

  C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](CO[C@H]2O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@H]5C4=CC[C@@]67[C@]5(C[C@@H]([C@@H]6[C@](OC7=O)(C)C(CCC(=C)C)OC(=O)C)OC(=O)C)C)C)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)OC)O)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)OC)O)O

• Std. InChi

  InChI=1S/C69H108O33/c1-27(2)13-16-41(93-30(5)73)68(10)57-35(92-29(4)72)21-67(9)32-14-15-39-65(6,7)40(18-19-66(39,8)31(32)17-20-69(57,67)64(85)102-68)97-63-56(44(78)38(26-90-63)96-58-47(81)52(33(74)24-88-58)99-61-49(83)54(86-11)42(76)36(22-70)94-61)101-60-46(80)45(79)51(28(3)91-60)98-59-48(82)53(34(75)25-89-59)100-62-50(84)55(87-12)43(77)37(23-71)95-62/h17,28,32-63,70-71,74-84H,1,13-16,18-26H2,2-12H3/t28-,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-,58+,59+,60+,61+,62+,63+,66-,67+,68+,69-/m1/s1

• Std. InChIKey

  HBQGEARVSGXUST-BFCXTMIMSA-N

• Cite this record

  CSID:44210746, http://www.chemspider.com/Chemical-Structure.44210746.html (accessed 18:06, Jun 1, 2024)