Products 16958-31-9

CAS 16958-31-9 is the registry number for Floridanine. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

Floridanine is a pyrrolizine alkaloid that is onetine in which the hydroxy hydrogen has been replaced by an acetyl group. It has a role as a Jacobaea metabolite. It is a diol, an organic heterobicyclic compound, a pyrrolizine alkaloid, an acetate ester, a tertiary amino compound, an enone and a macrocyclic lactone. It is functionally related to a onetine.

Source: ChEBI

Identity
Molecular formulaC21H31NO9
Molecular weight441.5 g/mol
IUPAC name[(1R,4S,6R,7R,11Z)-4-hydroxy-4-[(1R)-1-hydroxyethyl]-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
InChIKeyMPJBVZKNLCGQHF-XAHVSKGQSA-N
SMILESC[C@@H]1C[C@@](C(=O)O[C@@H]2CCN(C/C=C(\C2=O)/COC(=O)[C@]1(C)OC(=O)C)C)([C@@H](C)O)O

Computed by PubChem (NCBI)

Synonyms: Floridanine