Echimidine N-Oxide-D6

CAS: 41093-89-4

Ref. TR-E325587

Produktinformation

• Name: Echimidine N-Oxide-D6
• Synonyme: (1R,7aR)-7-((((R)-2,3-dihydroxy-2-((S)-1-hydroxyethyl)-3-(methyl-d3)butanoyl-4,4,4-d3)oxy)methyl)-1-(((Z)-2-methylbut-2-enoyl)oxy)-2,3,5,7a-tetrahydropyrrolizine 4(1H)-oxide
• Marke: TRC

Beschreibung

Applications (+)-Echimidine N-Oxide-D3 is a labelled analogue of (+)-Echimidine N-Oxide (E325585), a hepatotoxic pyrolizidine alkaloid that is present in honey, pollen, and comfrey tea leaves.
References Cao, Y., et al.: J. Food Comp. Anal., 29, 106 (2013); Hirono, I., et al.: J. Nat. Cancer Inst., 63, 469 (1979); Oberlies, N., et al.: Pub. Health Nut., 7, 919 (2004)

Chemische Eigenschaften

• Molekulargewicht: 416.481
• Formel: C₂₀D₆H₂₅NO₈
• Farbe/Form: Neat
• InChl: InChI=1S/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13-,15+,16+,20-,21?/m0/s1/i4D3,5D3
• InChI Key: InChIKey=KDJGEXAPDZNXSD-YEFMQTBZSA-N
• SMILES: [2H]C([2H])([2H])/C=C(/C)C(=O)O[C@@H]1CC[N+]2([O-])CC=C(COC(=O)[C@@](O)([C@H](C)O)C(C)(C)O)[C@H]12