CAS 548-42-5

(-)-Agroclavine

Description:

(-)-Agroclavine is a naturally occurring alkaloid belonging to the class of compounds known as ergot alkaloids, which are derived from the fungus Claviceps purpurea. This compound is characterized by its complex tetracyclic structure, which includes a fused indole and isoquinoline moiety. (-)-Agroclavine exhibits a range of biological activities, including potential effects on the central nervous system and vasoconstriction, making it of interest in pharmacological research. It is typically found in trace amounts in certain plants and fungi, and its stereochemistry is significant, as the (-) enantiomer is biologically active. The compound is soluble in organic solvents but has limited solubility in water. Due to its structural features, (-)-Agroclavine can interact with various neurotransmitter receptors, which may contribute to its physiological effects. Safety and toxicity profiles are important considerations in its study, as with many alkaloids, due to their potential for adverse effects at higher concentrations. Overall, (-)-Agroclavine represents a fascinating subject for further investigation in both natural product chemistry and pharmacology.

Formula: C₁₆H₁₈N₂

InChI: InChI=1/C16H18N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-6,8,13,15,17H,7,9H2,1-2H3

InChI key: InChIKey=XJOOMMHNYOJWCZ-UKRRQHHQSA-N

SMILES: CN1[C@]2([C@@](C=3C=4C(C2)=CNC4C=CC3)(C=C(C)C1)[H])[H]

Synonyms:

• 6,8-Dimethyl-8,9-Didehydroergoline
• Agroclavin
• Agroclavine
• Brn 0024966
• Ccris 2099
• Ergoline, 8,9-didehydro-6,8-dimethyl-
• Indolo(4,3-fg)quinoline, 4,6,6a,7,8,10a-hexahydro-7,9-dimethyl-
• Indolo[4,3-fg]quinoline, ergoline deriv.
• Nsc 93132
• 8,9-Didehydro-6,8-dimethylergoline
• 8,9-Didehydro-6,8-dimethylergoline
• 4-23-00-01623 (Beilstein Handbook Reference)

Agroclavine

Controlled Product

CAS: 548-42-5

Applications Agroclavine is an ergot alkaloid and a fungal metabolite. It is also an environmental and food contaminant.
References Mayer, S., et al.: Environ. Monit. Assess. 188, 1 (2016); Mendes de Souza, et al.: Scientific World J. 2013, 427369 (2013)

Formula: C₁₆H₁₈N₂

Color and Shape: Light Beige To Light Brown

Molecular weight: 238.33

Ref: TR-A430040

Agroclavine

CAS: 548-42-5

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Formula: C₁₆H₁₈N₂

Molecular weight: 238.33 g/mol

Ref: 3D-FA33486

Agroclavine

CAS: 548-42-5

Agroclavine is a clavine type of ergot alkaloid with D1 dopamine and a-adrenoceptor agonistic properties.

Formula: C₁₆H₁₈N₂

Color and Shape: Solid

Molecular weight: 238.33

Ref: TM-T69116