D9404

Digitoxigenin

• Synonym(e): 3β,14-Dihydroxy-5β,20(22)-Cardenolid, 3,14,21-Trihydroxy-20,22-norcholensäurelacton, 5β,20(22)-Cardenolide-3β,14-Diol
• Empirische Formel (Hill-System): C₂₃H₃₄O₄
• CAS-Nummer: 143-62-4
• Molekulargewicht: 374.51
• Beilstein: 95448
• EG-Nummer: 205-603-4
• MDL-Nummer: MFCD00003687
• UNSPSC-Code: 12161900
• PubChem Substanz-ID: 24894291
• NACRES: NA.25

Eigenschaften

• Beschreibung: non-ionic
• Qualitätsniveau: 200
• Assay: ≥97.0% (TLC)
• Form: powder
• Mol-Gew.: 374.51 g/mol
• mp (Schmelzpunkt): 253 °C (lit.)
• SMILES String: [H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@]34O)C5=CC(=O)OC5)[C@@]1(C)CC[C@H](O)C2
• InChI: 1S/C23H34O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23+/m1/s1
• InChIKey: XZTUSOXSLKTKJQ-CESUGQOBSA-N
• Angaben zum Gen: rat ... Atp1a1(24211)

Beschreibung

Allgemeine Beschreibung

Digitoxigenin is the aglycone of digitoxin.

Anwendung

Digitoxigenin has been used in a study to assess its stereochemical effects in cancer cytotoxicity. It has also been used in a study to investigate the advantage of gold(I)-catalyzed glycosidation of glycosyl o-alkyl benzoates to assemble digitoxin.

Sicherheitshinweise

• Piktogramme: GHS06
• Signalwort: Danger
• H-Sätze: H300
• P-Sätze: P264 - P270 - P301 + P310 - P405 - P501
• Gefahreneinstufungen: Acute Tox. 2 Oral
• Lagerklassenschlüssel: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• WGK: WGK 3
• Persönliche Schutzausrüstung: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges