Products 52279-57-9

CAS 52279-57-9 is the registry number for Anadur. Offered by: TRC. Available pack sizes: 100mg.

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

[(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 3-(4-hexoxyphenyl)propanoate (CAS 52279-57-9) is a chemical compound with the molecular formula C33H46O4 and a molecular weight of 506.7 g/mol. IUPAC name: [(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 3-(4-hexoxyphenyl)propanoate. InChIKey: PQKRYXHYWWQULJ-JMKYFRMNSA-N.

Identity
Molecular formulaC33H46O4
Molecular weight506.7 g/mol
IUPAC name[(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 3-(4-hexoxyphenyl)propanoate
InChIKeyPQKRYXHYWWQULJ-JMKYFRMNSA-N
SMILESCCCCCCOC1=CC=C(C=C1)CCC(=O)O[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CCC5=CC(=O)CC[C@H]45)C

Computed by PubChem (NCBI)