(3β,5β)-3-[(O-β-D-Glucopyranosyl-(1→6)-O-β-D-glucopyranosyl-(1→4)-O-2,6-dideoxy-β-D-xylo-hexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide

CAS Registry Number®

210637-19-7
No image available.

CAS Name

(3β,5β)-3-[(O-β-D-Glucopyranosyl-(1→6)-O-β-D-glucopyranosyl-(1→4)-O-2,6-dideoxy-β-D-xylo-hexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide

Molecular Formula

C41H64O19

Molecular Mass

860.94

Cite this Page

(3β,5β)-3-[(O-β-D-Glucopyranosyl-(1→6)-O-β-D-glucopyranosyl-(1→4)-O-2,6-dideoxy-β-D-xylo-hexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=210637-19-7 (retrieved 2024-09-20) (CAS RN: 210637-19-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C41H64O19/c1-18-35(60-37-34(51)32(49)30(47)26(59-37)16-55-36-33(50)31(48)29(46)25(14-42)58-36)24(44)12-28(56-18)57-20-3-8-39(17-43)22-4-7-38(2)21(19-11-27(45)54-15-19)6-10-41(38,53)23(22)5-9-40(39,52)13-20/h11,18,20-26,28-37,42-44,46-53H,3-10,12-17H2,1-2H3/t18-,20+,21-,22+,23-,24+,25-,26-,28+,29-,30-,31+,32+,33-,34-,35+,36-,37+,38-,39+,40+,41+/m1/s1

InChIKey

InChIKey=ZEGXQALGZJKCGX-OWLQQNDCSA-N

SMILES

C(O)[C@@]12[C@@]3([C@]([C@]4(O)[C@](C)(CC3)[C@H](CC4)C=5COC(=O)C5)(CC[C@]1(O)C[C@@H](O[C@H]6C[C@H](O)[C@@H](O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](C)O6)CC2)[H])[H]

Canonical SMILES

O=C1OCC(=C1)C2CCC3(O)C4CCC5(O)CC(OC6OC(C)C(OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O)C(O)C6)CCC5(CO)C4CCC23C

Other Names for this Substance

  • Card-20(22)-enolide, 3-[(O-β-D-glucopyranosyl-(1→6)-O-β-D-glucopyranosyl-(1→4)-O-2,6-dideoxy-β-D-xylo-hexopyranosyl)oxy]-5,14,19-trihydroxy-, (3β,5β)-
  • (3β,5β)-3-[(O-β-D-Glucopyranosyl-(1→6)-O-β-D-glucopyranosyl-(1→4)-O-2,6-dideoxy-β-D-xylo-hexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide
  • Corchorusoside E
  • Corchorusoside V