Products 101687-28-9

CAS 101687-28-9 appears in our catalog under these names: Senecivernine N-Oxide, Senecivernine-N-oxide 100 µg/mL in Water, Senecivernine N-oxide, ≥98%, ≥98%. Offered by: Chemat Brand, Dr. Ehrenstorfer, Biosynth, Chemat, HPC Standards. Available pack sizes: on request, 1ml, 2mg, 1mg, 5mg, 10mg, 25mg, 1x5mg.

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

Senecivernine N-oxide is a tertiary amine oxide, a tertiary alcohol, an organic heterotricyclic compound, a pyrrolizine alkaloid, a macrocyclic lactone and an olefinic compound. It has a role as a Jacobaea metabolite. It is functionally related to a Senecivernine.

Source: ChEBI

Identity
Molecular formulaC18H25NO6
Molecular weight351.4 g/mol
IUPAC name(1R,5R,6R,7R,17R)-7-hydroxy-5,6,7-trimethyl-4-methylidene-14-oxido-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
InChIKeyGDDNFNQRHNCJAZ-TURVAVEKSA-N
SMILESC[C@@H]1[C@H]([C@@](C(=O)OCC2=CC[N+]3([C@H]2[C@@H](CC3)OC(=O)C1=C)[O-])(C)O)C

Computed by PubChem (NCBI)