Products 142561-96-4

CAS 142561-96-4 appears in our catalog under these names: Zaragozic Acid A, Zaragozic Acid A, ZAragozic acid A, 98%, 98%, Zaragozic acid A, 99.2%. Offered by: Chemat Brand, GLPBio, Chemat, MedChemExpress. Available pack sizes: on request, 1mg, 1 mg.

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

Zaragozic acid A is a polyketide, a tertiary alcohol, a tricarboxylic acid, an oxabicycloalkane, an acetate ester and a cyclic ketal. It has a role as an EC 2.5.1.21 (squalene synthase) inhibitor and a fungal metabolite.

Source: ChEBI

Identity
Molecular formulaC35H46O14
Molecular weight690.7 g/mol
IUPAC name(1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methylidene-6-phenylhexyl]-6-[(E,4S,6S)-4,6-dimethyloct-2-enoyl]oxy-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
InChIKeyDFKDOZMCHOGOBR-NCSQYGPNSA-N
SMILESCC[C@H](C)C[C@H](C)/C=C/C(=O)O[C@@H]1[C@H]([C@]2(O[C@@H]([C@]([C@@]1(O2)C(=O)O)(C(=O)O)O)C(=O)O)CCC(=C)[C@H]([C@H](C)CC3=CC=CC=C3)OC(=O)C)O

Computed by PubChem (NCBI)