Products 59015-72-4

CAS 59015-72-4 appears in our catalog under these names: 2-epi-Cucurbitacin B, 2-Epicucurbitacin B, ≥98%. Offered by: MedChemExpress, Chemat. Available pack sizes: Get quote, 2mg.

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

[(E,6R)-6-[(2R,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate (CAS 59015-72-4) is a chemical compound with the molecular formula C32H46O8 and a molecular weight of 558.7 g/mol. IUPAC name: [(E,6R)-6-[(2R,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate. InChIKey: IXQKXEUSCPEQRD-PBMNGLKCSA-N.

Identity
Molecular formulaC32H46O8
Molecular weight558.7 g/mol
IUPAC name[(E,6R)-6-[(2R,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate
InChIKeyIXQKXEUSCPEQRD-PBMNGLKCSA-N
SMILESCC(=O)OC(C)(C)/C=C/C(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@H](C(=O)C4(C)C)O)C)C)C)O)O

Computed by PubChem (NCBI)