12-Demethyl neocaesalpin F

cas: 1228964-10-0 — see every product listed under this CAS number, including other names

12-Demethyl neocaesalpin F (CAS 1228964-10-0) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas1228964-10-0
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Structural formula: {0} (CAS {1})

[(4aR,5R,6R,6aS,7R,10aR,11aS,11bR)-4a,6,10a-trihydroxy-4,4,7,11b-tetramethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] benzoate (CAS 1228964-10-0) is a chemical compound with the molecular formula C27H34O7 and a molecular weight of 470.6 g/mol. IUPAC name: [(4aR,5R,6R,6aS,7R,10aR,11aS,11bR)-4a,6,10a-trihydroxy-4,4,7,11b-tetramethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] benzoate. InChIKey: VHLRSKHOMKTLFY-WKAYIHASSA-N.

Identity
Molecular formulaC27H34O7
Molecular weight470.6 g/mol
IUPAC name[(4aR,5R,6R,6aS,7R,10aR,11aS,11bR)-4a,6,10a-trihydroxy-4,4,7,11b-tetramethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] benzoate
InChIKeyVHLRSKHOMKTLFY-WKAYIHASSA-N
SMILESC[C@@H]1[C@H]2[C@H](C[C@@]3(C1=CC(=O)O3)O)[C@]4(CCCC([C@@]4([C@@H]([C@@H]2O)OC(=O)C5=CC=CC=C5)O)(C)C)C

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