Cephalonic acid

cas: 18456-04-7 — see every product listed under this CAS number, including other names

Cephalonic acid (CAS 18456-04-7) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas18456-04-7
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Structural formula: {0} (CAS {1})

(1R,3R,7Z,11S,12R)-9-hydroxy-1,4-dimethyl-12-[(2S)-6-methylhept-5-en-2-yl]-6-oxotricyclo[9.3.0.03,7]tetradeca-4,7-diene-8-carboxylic acid (CAS 18456-04-7) is a chemical compound with the molecular formula C25H36O4 and a molecular weight of 400.5 g/mol. IUPAC name: (1R,3R,7Z,11S,12R)-9-hydroxy-1,4-dimethyl-12-[(2S)-6-methylhept-5-en-2-yl]-6-oxotricyclo[9.3.0.03,7]tetradeca-4,7-diene-8-carboxylic acid. InChIKey: YNWCHERLWLNYDO-ZWQYIRPLSA-N.

Identity
Molecular formulaC25H36O4
Molecular weight400.5 g/mol
IUPAC name(1R,3R,7Z,11S,12R)-9-hydroxy-1,4-dimethyl-12-[(2S)-6-methylhept-5-en-2-yl]-6-oxotricyclo[9.3.0.03,7]tetradeca-4,7-diene-8-carboxylic acid
InChIKeyYNWCHERLWLNYDO-ZWQYIRPLSA-N
SMILESCC1=CC(=O)/C/2=C(/C(C[C@H]3[C@H](CC[C@@]3(C[C@H]12)C)[C@@H](C)CCC=C(C)C)O)\C(=O)O

Computed by PubChem (NCBI)

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