Products 25514-31-2

CAS 25514-31-2 appears in our catalog under these names: Bruceantin A, >95% (HPLC), Bruceine A/ 99.45% (existing batch purity), Bruceine A, Bruceine A, Bruceine A, 98+%, 98+%. Offered by: TRC, TargetMol, GLPBio, Biosynth, Chemat. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, 5 mg, 10mM/1mL.

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

Bruceine A is a quassinoid.

Source: ChEBI

Identity
Molecular formulaC26H34O11
Molecular weight522.5 g/mol
IUPAC namemethyl (1R,2S,3R,6R,8R,13S,14R,15R,16S,17S)-10,15,16-trihydroxy-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-17-carboxylate
InChIKeyLPZSTPCYWWRQFU-VILODJCFSA-N
SMILESCC1=C(C(=O)C[C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H]([C@@H]([C@]([C@@H]4[C@H](C(=O)O3)OC(=O)CC(C)C)(OC5)C(=O)OC)O)O)C)O

Computed by PubChem (NCBI)