Products 22888-70-6

CAS 22888-70-6 appears in our catalog under these names: Silybin A, Silybin A, >95% (HPLC), Silibinin, Silibinin/ 99.76% (existing batch purity), Silybin. Offered by: Chemat Brand, TRC, GLPBio, TargetMol, Biosynth. Available pack sizes: on request, 10mg, 1mg, 20mg, 10mM (in 1ml dmso), 50mg, 100mg, 10g.

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

Silibinin is a flavonolignan isolated from milk thistle, Silybum marianum, that has been shown to exhibit antioxidant and antineoplastic activities. It has a role as an antioxidant, an antineoplastic agent, a hepatoprotective agent and a plant metabolite. It is a secondary alpha-hydroxy ketone, a polyphenol, an aromatic ether, a benzodioxine and a flavonolignan.

Source: ChEBI

Identity
Molecular formulaC25H22O10
Molecular weight482.4 g/mol
IUPAC name(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one
InChIKeySEBFKMXJBCUCAI-HKTJVKLFSA-N
SMILESCOC1=C(C=CC(=C1)[C@@H]2[C@H](OC3=C(O2)C=C(C=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O

Computed by PubChem (NCBI)