Products 18456-03-6

CAS 18456-03-6 appears in our catalog under these names: Bakkenolide D, Bakkenolide D, ≥98%. Offered by: MedChemExpress, Chemat. Available pack sizes: 1 mg, 5 mg, 10 mg, 20mg.

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

[(2R,3R,3aR,4S,7S,7aR)-3-acetyloxy-7,7a-dimethyl-4'-methylidene-2'-oxospiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-4-yl] (Z)-3-methylsulfanylprop-2-enoate (CAS 18456-03-6) is a chemical compound with the molecular formula C21H28O6S and a molecular weight of 408.5 g/mol. IUPAC name: [(2R,3R,3aR,4S,7S,7aR)-3-acetyloxy-7,7a-dimethyl-4'-methylidene-2'-oxospiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-4-yl] (Z)-3-methylsulfanylprop-2-enoate. InChIKey: LWHLMCCRIWZBQO-PDSBHGERSA-N.

Identity
Molecular formulaC21H28O6S
Molecular weight408.5 g/mol
IUPAC name[(2R,3R,3aR,4S,7S,7aR)-3-acetyloxy-7,7a-dimethyl-4'-methylidene-2'-oxospiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-4-yl] (Z)-3-methylsulfanylprop-2-enoate
InChIKeyLWHLMCCRIWZBQO-PDSBHGERSA-N
SMILESC[C@H]1CC[C@@H]([C@H]2[C@@]1(C[C@]3([C@@H]2OC(=O)C)C(=C)COC3=O)C)OC(=O)/C=C\SC

Computed by PubChem (NCBI)