Products 30219-16-0

CAS 30219-16-0 appears in our catalog under these names: (3beta,5beta,11alpha)-3-[(7-Carboxy-1-oxoheptyl)oxy]-11,14-dihydroxy-12-oxo-bufa-20,22-dienolide, ≥98%, ≥98%, Arenobufagin 3-hemisuberate. Offered by: Chemat, MedChemExpress. Available pack sizes: 5mg, 10mg, 25mg.

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

8-[[(3S,5R,8R,9S,10S,11S,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-12-oxo-17-(6-oxopyran-3-yl)-2,3,4,5,6,7,8,9,11,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-8-oxooctanoic acid (CAS 30219-16-0) is a chemical compound with the molecular formula C32H44O9 and a molecular weight of 572.7 g/mol. IUPAC name: 8-[[(3S,5R,8R,9S,10S,11S,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-12-oxo-17-(6-oxopyran-3-yl)-2,3,4,5,6,7,8,9,11,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-8-oxooctanoic acid. InChIKey: LYCCSNYEMCXNRM-QCTKBPTFSA-N.

Identity
Molecular formulaC32H44O9
Molecular weight572.7 g/mol
IUPAC name8-[[(3S,5R,8R,9S,10S,11S,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-12-oxo-17-(6-oxopyran-3-yl)-2,3,4,5,6,7,8,9,11,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-8-oxooctanoic acid
InChIKeyLYCCSNYEMCXNRM-QCTKBPTFSA-N
SMILESC[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2[C@@H](C(=O)[C@]4([C@@]3(CC[C@@H]4C5=COC(=O)C=C5)O)C)O)OC(=O)CCCCCCC(=O)O

Computed by PubChem (NCBI)