Products 89210-68-4

CAS 89210-68-4 is the registry number for Cholesteryl γ-aminobutyrate. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

4-[[(3S,10R,13R,17R)-3-hydroxy-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-4-yl]amino]butanoic acid (CAS 89210-68-4) is a chemical compound with the molecular formula C31H53NO3 and a molecular weight of 487.8 g/mol. IUPAC name: 4-[[(3S,10R,13R,17R)-3-hydroxy-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-4-yl]amino]butanoic acid. InChIKey: XKAKGVWSPKWVGH-RLXQBPMMSA-N.

Identity
Molecular formulaC31H53NO3
Molecular weight487.8 g/mol
IUPAC name4-[[(3S,10R,13R,17R)-3-hydroxy-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-4-yl]amino]butanoic acid
InChIKeyXKAKGVWSPKWVGH-RLXQBPMMSA-N
SMILESC[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2CC=C4[C@@]3(CC[C@@H](C4NCCCC(=O)O)O)C)C

Computed by PubChem (NCBI)