Products 521-13-1

CAS 521-13-1 appears in our catalog under these names: Cholesteryl N-Butyrate, Cholesteryl n–butyrate, Cholesterol Butyrate, >95.0%(GC), Cholesterol butyrate, Cholesteryl n-butyrate, 98%, 98%. Offered by: TRC, GLPBio, TCI, Biosynth, Chemat. Available pack sizes: 10g, 50g, 5g, 100g, 25g, 250g, 1g, 250mg.

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

[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] butanoate (CAS 521-13-1) is a chemical compound with the molecular formula C31H52O2 and a molecular weight of 456.7 g/mol. IUPAC name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] butanoate. InChIKey: CKDZWMVGDHGMFR-GTPODGLVSA-N.

Identity
Molecular formulaC31H52O2
Molecular weight456.7 g/mol
IUPAC name[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] butanoate
InChIKeyCKDZWMVGDHGMFR-GTPODGLVSA-N
SMILESCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C

Computed by PubChem (NCBI)