Products 5066-78-4

CAS 5066-78-4 appears in our catalog under these names: Chasmanine, CHASMANINE, ≥98%. Offered by: Chemat, MedChemExpress. Available pack sizes: 1mg, 5mg, 5 mg, 1 mg, 10mg.

Structural formula: {0} (CAS {1})

Chasmanine is a diterpene alkaloid with formula C25H41NO6 that is isolated from several Aconitum species. It has a role as an antifeedant and a plant metabolite. It is a diol, a diterpene alkaloid, a tertiary alcohol, a secondary alcohol, a bridged compound, an organic heteropolycyclic compound, a polyether and a tertiary amino compound. It derives from a hydride of an aconitane.

Source: ChEBI

Identity
Molecular formulaC25H41NO6
Molecular weight451.6 g/mol
IUPAC name(1S,2R,3R,4S,5S,6S,8R,9R,13S,16S,17R,18R)-11-ethyl-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8-diol
InChIKeyDBODJJZRZFZBBD-RIVIBFSZSA-N
SMILESCCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6O)OC)O)OC)OC)COC

Computed by PubChem (NCBI)