(3β,5β)-3-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide

CAS Registry Number®

29336-13-8
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CAS Name

(3β,5β)-3-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide

Molecular Formula

C29H44O10

Molecular Mass

552.65

Cite this Page

(3β,5β)-3-[(6-Deoxy-β-D-gulopyranosyl)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=29336-13-8 (retrieved 2024-09-20) (CAS RN: 29336-13-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H44O10/c1-15-22(32)23(33)24(34)25(38-15)39-17-3-8-27(14-30)19-4-7-26(2)18(16-11-21(31)37-13-16)6-10-29(26,36)20(19)5-9-28(27,35)12-17/h11,15,17-20,22-25,30,32-36H,3-10,12-14H2,1-2H3/t15-,17+,18-,19+,20-,22+,23-,24-,25+,26-,27+,28+,29+/m1/s1

InChIKey

InChIKey=UQEKVLJMBGSQGS-PZXOABCJSA-N

SMILES

C(O)[C@@]12[C@@]3([C@]([C@]4(O)[C@](C)(CC3)[C@H](CC4)C5=CC(=O)OC5)(CC[C@]1(O)C[C@@H](O[C@H]6[C@H](O)[C@H](O)[C@@H](O)[C@@H](C)O6)CC2)[H])[H]

Canonical SMILES

O=C1OCC(=C1)C2CCC3(O)C4CCC5(O)CC(OC6OC(C)C(O)C(O)C6O)CCC5(CO)C4CCC23C

Other Names for this Substance

  • Card-20(22)-enolide, 3-[(6-deoxy-β-D-gulopyranosyl)oxy]-5,14,19-trihydroxy-, (3β,5β)-
  • 5β-Card-20(22)-enolide, 3β-[(6-deoxy-β-D-gulopyranosyl)oxy]-5,14,19-trihydroxy-
  • (3β,5β)-3-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide
  • Deglucocheirotoxol
  • Strophanthidol 3-β-D-gulomethyloside

Deleted or Replaced CAS Registry Numbers

82496-89-7