Products 184432-08-4

CAS 184432-08-4 is the registry number for Andrastin D. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

Andrastin D is a 3-oxo steroid that is andrastin C in which the acetoxy group at the 3beta position has undergone formal oxidative cleavage to afford the corresponding 3-oxo derivative. A farnesyltransferase inhibitor produced by Penicillium roqueforti, a filamentous fungus involved in the ripening of several kinds of blue cheeses. It has a role as an EC 2.5.1.58 (protein farnesyltransferase) inhibitor and a Penicillium metabolite. It is a 5beta steroid, a 17-oxo steroid, a methyl ester, an enol, a 15-hydroxy steroid, a 3-oxo steroid and a meroterpenoid. It is a conjugate acid of an andrastin D(1-).

Source: ChEBI

Identity
Molecular formulaC26H36O5
Molecular weight428.6 g/mol
IUPAC namemethyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate
InChIKeySMUNNMAWNRFDPB-UWWAQUNASA-N
SMILESCC1=C[C@H]2[C@@]3(CCC(=O)C([C@H]3CC[C@@]2([C@]4([C@@]1(C(=C(C4=O)C)O)C)C(=O)OC)C)(C)C)C

Computed by PubChem (NCBI)

Synonyms: Andrastin D, orb2942917