Products 4952-68-5

CAS 4952-68-5 is the registry number for 3-O-Benzoyl Diosgenine. Offered by: TRC. Available pack sizes: 100mg, 250mg, 500mg.

3-O-Benzoyl Diosgenine
TRC
  • size: 100mg, 250mg, 500mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl] benzoate (CAS 4952-68-5) is a chemical compound with the molecular formula C34H46O4 and a molecular weight of 518.7 g/mol. IUPAC name: [(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl] benzoate. InChIKey: CWUJEAGCIAAOMQ-RTDPTVCESA-N.

Identity
Molecular formulaC34H46O4
Molecular weight518.7 g/mol
IUPAC name[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl] benzoate
InChIKeyCWUJEAGCIAAOMQ-RTDPTVCESA-N
SMILESC[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@H](C6)OC(=O)C7=CC=CC=C7)C)C)C)OC1

Computed by PubChem (NCBI)

Synonyms: 3-O-Benzoyl Diosgenine, (3beta,25R)-Spirost-5-en-3-ol Benzoate; Diosgenin Benzoate;, (25R)-Spirost-5-en-3alpha-yl benzoate, (3alpha,25R)-Spirost-5-en-3-yl benzoate