Celangulin II

cas: 144379-41-9 — see every product listed under this CAS number, including other names

Celangulin II (CAS 144379-41-9) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-N7941-Get quote
cas144379-41-9
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Structural formula: {0} (CAS {1})

[(1S,2S,4S,5R,6S,7R,8R,9R,12R)-4,5,12-triacetyloxy-7-(furan-3-carbonyloxy)-2-hydroxy-2,10,10-trimethyl-6-(2-methylpropanoyloxymethyl)-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] furan-3-carboxylate (CAS 144379-41-9) is a chemical compound with the molecular formula C35H42O16 and a molecular weight of 718.7 g/mol. IUPAC name: [(1S,2S,4S,5R,6S,7R,8R,9R,12R)-4,5,12-triacetyloxy-7-(furan-3-carbonyloxy)-2-hydroxy-2,10,10-trimethyl-6-(2-methylpropanoyloxymethyl)-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] furan-3-carboxylate. InChIKey: WSXXLLLVOJEZCC-DUHPUZQDSA-N.

Identity
Molecular formulaC35H42O16
Molecular weight718.7 g/mol
IUPAC name[(1S,2S,4S,5R,6S,7R,8R,9R,12R)-4,5,12-triacetyloxy-7-(furan-3-carbonyloxy)-2-hydroxy-2,10,10-trimethyl-6-(2-methylpropanoyloxymethyl)-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] furan-3-carboxylate
InChIKeyWSXXLLLVOJEZCC-DUHPUZQDSA-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)C5=COC=C5)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C)OC(=O)C

Computed by PubChem (NCBI)

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