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30000-36-3

30000-36-3 Structure

30000-36-3 Structure
IdentificationBack Directory
[Name]

Isoline
[CAS]

30000-36-3
[Synonyms]

Isoline
Isoline【alkaloid】
(12S)-12-Acetoxy-15,20-dihydro-15β-hydroxysenecionan-11,16-dione
(12S,15S)-12-Acetoxy-15,20-dihydro-15-hydroxysenecionan-11,16-dione
[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione, 6-(acetyloxy)-3-ethyl-3,4,5,6,9,11,13,14,14a,14b-decahydro-3-hydroxy-5,6-dimethyl-, (3R,5R,6S,14aR,14bR)-
[Molecular Formula]

C20H29NO7
[MDL Number]

MFCD22479210
[MOL File]

30000-36-3.mol
[Molecular Weight]

395.45
Chemical PropertiesBack Directory
[Melting point ]

l73°C
[Boiling point ]

584.1±50.0 °C(Predicted)
[density ]

1.27±0.1 g/cm3(Predicted)
[pka]

12.67±0.60(Predicted)
Hazard InformationBack Directory
[Description]

Senecio othonniformis yields this alkaloid which forms colourless crystals when recrystallized from Me2CO-light petroleum. The alkaloid has [α]29D?? - 4.8° (c 1.78, EtOH). Alkaline hydrolysis yields retronecine, acetic acid and isolinecic acid. Mass spectral data and chemical degradation studies have shown the latter to be 2: 5-dihydroxy-3-methylheptane-2: 5-dicarboxylic acid or the 2 A-dihydroxy isomer.
[References]

Gordon-Gray, Coucourakis.,J. Chern. Soc., C, 2312 (1970)
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