Products 1000784-47-3

CAS 1000784-47-3 is the registry number for Celangulatin F. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

[(1S,2S,4S,5R,6S,7R,8R,9R,12R)-4,5,8,12-tetraacetyloxy-2-hydroxy-2,10,10-trimethyl-6-(2-methylpropanoyloxymethyl)-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] furan-3-carboxylate (CAS 1000784-47-3) is a chemical compound with the molecular formula C32H42O15 and a molecular weight of 666.7 g/mol. IUPAC name: [(1S,2S,4S,5R,6S,7R,8R,9R,12R)-4,5,8,12-tetraacetyloxy-2-hydroxy-2,10,10-trimethyl-6-(2-methylpropanoyloxymethyl)-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] furan-3-carboxylate. InChIKey: JJONTKOSVMSWDE-NGBACCPXSA-N.

Identity
Molecular formulaC32H42O15
Molecular weight666.7 g/mol
IUPAC name[(1S,2S,4S,5R,6S,7R,8R,9R,12R)-4,5,8,12-tetraacetyloxy-2-hydroxy-2,10,10-trimethyl-6-(2-methylpropanoyloxymethyl)-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] furan-3-carboxylate
InChIKeyJJONTKOSVMSWDE-NGBACCPXSA-N
SMILESCC(C)C(=O)OC[C@@]12[C@H]([C@H](C[C@]([C@@]13[C@@H]([C@@H]([C@H]([C@@H]2OC(=O)C4=COC=C4)OC(=O)C)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C)OC(=O)C

Computed by PubChem (NCBI)

Synonyms: orb3179808