Products 88497-87-4

CAS 88497-87-4 appears in our catalog under these names: Manassantin A, Manassantin A, ROTICHROM® HPLC, 10 mg, glass. Offered by: TRC, Biosynth, MedChemExpress, Roth. Available pack sizes: 2,5mg, 25mg, 10mg, 50mg, Get quote.

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

Manassantin A is a lignan, a member of oxolanes, a secondary alcohol and a dimethoxybenzene. It has a role as a metabolite and an antineoplastic agent.

Source: ChEBI

Identity
Molecular formulaC42H52O11
Molecular weight732.9 g/mol
IUPAC name(1R,2R)-1-(3,4-dimethoxyphenyl)-2-[4-[(2S,3R,4R,5S)-5-[4-[(1R,2R)-1-(3,4-dimethoxyphenyl)-1-hydroxypropan-2-yl]oxy-3-methoxyphenyl]-3,4-dimethyloxolan-2-yl]-2-methoxyphenoxy]propan-1-ol
InChIKeyZGXXNVOBEIRACL-VOGCUZRYSA-N
SMILESC[C@@H]1[C@H]([C@H](O[C@@H]1C2=CC(=C(C=C2)O[C@H](C)[C@@H](C3=CC(=C(C=C3)OC)OC)O)OC)C4=CC(=C(C=C4)O[C@H](C)[C@@H](C5=CC(=C(C=C5)OC)OC)O)OC)C

Computed by PubChem (NCBI)