Products 68455-09-4

CAS 68455-09-4 appears in our catalog under these names: Mollicellin H, 3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, ≥95%. Offered by: MedChemExpress, Chemat. Available pack sizes: Get quote, 5mg.

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

Mollicellin H is a member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by hydroxy groups at position 3 and 7, methyl group at positions 1 and 9, a prenyl group at position 8, an oxo group at position 11 and a formyl group at position 4. Isolated from Chaetomium brasiliense it exhibits cytotoxic activity. It has a role as an antineoplastic agent and a Chaetomium metabolite. It is an aldehyde, a polyphenol, an organic heterotricyclic compound and a member of depsidones.

Source: ChEBI

Identity
Molecular formulaC21H20O6
Molecular weight368.4 g/mol
IUPAC name2,9-dihydroxy-4,7-dimethyl-3-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde
InChIKeyFMQCQXQSBWELFR-UHFFFAOYSA-N
SMILESCC1=CC(=C(C2=C1C(=O)OC3=C(O2)C=C(C(=C3C)CC=C(C)C)O)C=O)O

Computed by PubChem (NCBI)