(3β,5β,16β)-16-(Formyloxy)-3,14-dihydroxycard-20(22)-enolide

CAS Registry Number®

514-21-6
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CAS Name

(3β,5β,16β)-16-(Formyloxy)-3,14-dihydroxycard-20(22)-enolide

Molecular Formula

C24H34O6

Molecular Mass

418.52

Cite this Page

(3β,5β,16β)-16-(Formyloxy)-3,14-dihydroxycard-20(22)-enolide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=514-21-6 (retrieved 2024-05-18) (CAS RN: 514-21-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    215-217 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C24H34O6/c1-22-7-5-16(26)10-15(22)3-4-18-17(22)6-8-23(2)21(14-9-20(27)29-12-14)19(30-13-25)11-24(18,23)28/h9,13,15-19,21,26,28H,3-8,10-12H2,1-2H3/t15-,16+,17+,18-,19+,21+,22+,23-,24+/m1/s1

InChIKey

InChIKey=WPPUBSWJDJKYDK-QDLCSJEJSA-N

SMILES

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

Canonical SMILES

O=COC1CC2(O)C3CCC4CC(O)CCC4(C)C3CCC2(C)C1C5=CC(=O)OC5

Other Names for this Substance

  • Card-20(22)-enolide, 16-(formyloxy)-3,14-dihydroxy-, (3β,5β,16β)-
  • 5β-Card-20(22)-enolide, 3β,14,16β-trihydroxy-, 16-formate
  • Gitaloxigenin
  • (3β,5β,16β)-16-(Formyloxy)-3,14-dihydroxycard-20(22)-enolide

Deleted or Replaced CAS Registry Numbers

25875-36-9

CAS INSIGHTSTM
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