Products 96801-92-2

CAS 96801-92-2 is the registry number for Chlorovaltrate K. Offered by: Biosynth, MedChemExpress. Available pack sizes: 10mg, 5mg, 25mg, 50mg, Get quote.

Chlorovaltrate K
Biosynth, MedChemExpress
  • size: 10mg, 5mg, 25mg, 50mg
  • Variants: 5
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Structural formula: {0} (CAS {1})

[(1S,4aS,6S,7S,7aS)-6-acetyloxy-7-(chloromethyl)-7-hydroxy-1-(3-methylbutanoyloxy)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate (CAS 96801-92-2) is a chemical compound with the molecular formula C22H33ClO8 and a molecular weight of 460.9 g/mol. IUPAC name: [(1S,4aS,6S,7S,7aS)-6-acetyloxy-7-(chloromethyl)-7-hydroxy-1-(3-methylbutanoyloxy)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate. InChIKey: QERAXRDNYJPTRN-PNBTUHDLSA-N.

Identity
Molecular formulaC22H33ClO8
Molecular weight460.9 g/mol
IUPAC name[(1S,4aS,6S,7S,7aS)-6-acetyloxy-7-(chloromethyl)-7-hydroxy-1-(3-methylbutanoyloxy)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate
InChIKeyQERAXRDNYJPTRN-PNBTUHDLSA-N
SMILESCC(C)CC(=O)OCC1=CO[C@H]([C@H]2[C@@H]1C[C@@H]([C@@]2(CCl)O)OC(=O)C)OC(=O)CC(C)C

Computed by PubChem (NCBI)

Synonyms: Chlorovaltrate K, orb1682950