Products 133585-55-4

CAS 133585-55-4 is the registry number for Sandoricin. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

Methyl 2-[(1S,3S,5S,7S,8S,9R,11S,12S,13S,16S)-5,11-diacetyloxy-13-(furan-3-yl)-16-hydroxy-6,6,8,12-tetramethyl-17-methylidene-15-oxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate (CAS 133585-55-4) is a chemical compound with the molecular formula C31H40O11 and a molecular weight of 588.6 g/mol. IUPAC name: methyl 2-[(1S,3S,5S,7S,8S,9R,11S,12S,13S,16S)-5,11-diacetyloxy-13-(furan-3-yl)-16-hydroxy-6,6,8,12-tetramethyl-17-methylidene-15-oxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate. InChIKey: FPZCLGWPFTXULY-AAZWCSCHSA-N.

Identity
Molecular formulaC31H40O11
Molecular weight588.6 g/mol
IUPAC namemethyl 2-[(1S,3S,5S,7S,8S,9R,11S,12S,13S,16S)-5,11-diacetyloxy-13-(furan-3-yl)-16-hydroxy-6,6,8,12-tetramethyl-17-methylidene-15-oxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate
InChIKeyFPZCLGWPFTXULY-AAZWCSCHSA-N
SMILESCC(=O)O[C@H]1C[C@H]2C(=C)[C@@]3([C@@]1([C@@H](OC(=O)[C@H]3O)C4=COC=C4)C)O[C@@H]5[C@]2([C@H](C([C@H](C5)OC(=O)C)(C)C)CC(=O)OC)C

Computed by PubChem (NCBI)

Synonyms: Sandoricin, orb1695313