Resibufogenin

CAS Registry Number®

465-39-4

CAS Name

Resibufogenin

Molecular Formula

C24H32O4

Molecular Mass

384.51

Cite this Page

Resibufogenin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=465-39-4 (retrieved 2024-12-19) (CAS RN: 465-39-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    155 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C24H32O4/c1-22-9-7-16(25)11-15(22)4-5-18-17(22)8-10-23(2)19(12-20-24(18,23)28-20)14-3-6-21(26)27-13-14/h3,6,13,15-20,25H,4-5,7-12H2,1-2H3/t15-,16+,17+,18-,19-,20-,22+,23-,24-/m1/s1

InChIKey

InChIKey=ATLJNLYIJOCWJE-CWMZOUAVSA-N

SMILES

C[C@]12[C@]3([C@](O3)(C[C@@H]1C=4C=CC(=O)OC4)[H])[C@]5([C@](CC2)([C@]6(C)[C@](CC5)(C[C@@H](O)CC6)[H])[H])[H]

Canonical SMILES

O=C1OC=C(C=C1)C2CC3OC34C5CCC6CC(O)CCC6(C)C5CCC24C

Other Names for this Substance

  • Bufa-20,22-dienolide, 14,15-epoxy-3-hydroxy-, (3β,5β,15β)-
  • 5β-Bufa-20,22-dienolide, 14,15β-epoxy-3β-hydroxy-
  • (3β,5β,15β)-14,15-Epoxy-3-hydroxybufa-20,22-dienolide
  • Bufogenin
  • 14,15β-Epoxy-3β-hydroxy-5β-bufa-20,22-dienolide

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