Structure via PubChem · Public domain (PubChem)
بوفتیونین
Sign in to saveBufothionine is a sulfur-containing compound which is present in the bufotoxins secreted by the parotoid gland of certain toads of the genera Bufo and Chaunus. The structure has been shown by X-ray crystallography to be (1,3,4,5-tetrahydro-5,5-dimethylpyrrolo-[4,3,2-de]quinolinio)-6-sulfate. This specific compound can be found in the skin of certain species of toad such as the Asiatic Toad, Chaunus arunco, Chaunus crucifer, Chaunus spinulosus, and Chaunus arenarum.
Chemical data
- Formula
- C12H14N2O4S
- Molecular weight
- 282.32 g/mol
- IUPAC name
- (7,7-dimethyl-2-aza-7-azoniatricyclo[6.3.1.04,12]dodeca-1(12),3,8,10-tetraen-9-yl) sulfate
- SMILES
- C[N+]1(CCC2=CNC3=C2C1=C(C=C3)OS(=O)(=O)[O-])C
- InChIKey
- VANPWLVSXXJWMF-UHFFFAOYSA-N
- XLogP
- 1
- Polar surface area
- 90.6 Ų
- H-bond donors
- 1
- H-bond acceptors
- 4
- Formal charge
- 0
via PubChem
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 282.06742811
Show 2 more facts
- canonical SMILES
- C[N+]1(CCC2=CNC3=C2C1=C(C=C3)OS(=O)(=O)[O-])C
- chemical formula
- C₁₂H₁₄N₂O₄S
Sources (1)
via Wikidata · CC0