Molecule

histrionicotoxin

AlkaPlorer ID: AK069308

Synonym: '', 'Histrionicotoxin'

IUPAC Name: (2S,6R,10S,11S)-11-[(Z)-but-1-en-3-ynyl]-2-[(Z)-pent-2-en-4-ynyl]-1-azaspiro[5.5]undecan-10-ol

Structure

SMILES: C#C/C=C\C[C@@H]1CCC[C@]2(CCC[C@H](O)[C@H]2/C=C\C#C)N1

InChI: InChI=1S/C19H25NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h1-2,5-7,12,16-18,20-21H,8-11,13-15H2/b7-5-,12-6-/t16-,17-,18+,19-/m1/s1

InChIKey: JBRYWENFVHQBGY-AFVFYVOOSA-N

Reference

Occurrence of skin alkaloids in non-dendrobatid frogs from Brazil (Bufonidae), Australia (Myobatrachidae) and Madagascar (Mantellinae)

PubChem CID: 6437364

LOTUS: LTS0039172

SuperNatural Ⅲ: SN0161179-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Mantella madagascariensis	Mantella	Mantellidae	Anura	Amphibia	Chordata	Metazoa	Eukaryota

Properties Information

Molecule Weight: 283.415

TPSA？: 32.26

MolLogP？: 2.797200000000001

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi