Products 223556-65-8

CAS 223556-65-8 is the registry number for Beraprost Impurity 63. Offered by: Chemat Brand. Available pack sizes: on request.

Beraprost Impurity 63
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

Methyl 4-[(1R,2R,3aS,8bS)-2-hydroxy-1-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoate (CAS 223556-65-8) is a chemical compound with the molecular formula C25H32O5 and a molecular weight of 412.5 g/mol. IUPAC name: methyl 4-[(1R,2R,3aS,8bS)-2-hydroxy-1-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoate. InChIKey: KJJSQLNNCPOREA-FCGLVAOLSA-N.

Identity
Molecular formulaC25H32O5
Molecular weight412.5 g/mol
IUPAC namemethyl 4-[(1R,2R,3aS,8bS)-2-hydroxy-1-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoate
InChIKeyKJJSQLNNCPOREA-FCGLVAOLSA-N
SMILESCC#CCC(C)[C@@H](/C=C/[C@H]1[C@@H](C[C@H]2[C@@H]1C3=CC=CC(=C3O2)CCCC(=O)OC)O)O

Computed by PubChem (NCBI)

Synonyms: Beraprost Impurity 63, Beraprost Impurity 64
Related forms of this compound
methyl 4-[(1R,2R,3aS,8bS)-2-hydroxy-1-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoate C25H32O5
methyl 4-[(1R,2R,3aS,8bS)-2-hydroxy-1-[(E,3S,4S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoate C25H32O5
methyl 4-[2-hydroxy-1-(3-hydroxy-4-methyloct-1-en-6-ynyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoate C25H32O5
Isomers (same molecular formula)
(1S,2S,4R,8S,9S,13S)-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-11,14,17-trien-16-one C25H32O5