(S)-2-(1,3-dihydro-4,6-dihydroxy-1-oxo-5-(3,7,11-trimethyl-2,6,10-dodecatrien-1-yl)-2H-isoindol-2-yl)-Pentanedioic acid

cas: 1295504-61-8 — see every product listed under this CAS number, including other names

(S)-2-(1,3-dihydro-4,6-dihydroxy-1-oxo-5-(3,7,11-trimethyl-2,6,10-dodecatrien-1-yl)-2H-isoindol-2-yl)-Pentanedioic acid (CAS 1295504-61-8) is a chemical reagent available from Chemat. Available pack sizes: 25mg. Offered by: TRC.

brandTRC
catalog numberTRC-D414600-25MG
cas1295504-61-8
size25mg
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properties

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

(2S)-2-[5,7-dihydroxy-3-oxo-6-[(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1H-isoindol-2-yl]pentanedioic acid (CAS 1295504-61-8) is a chemical compound with the molecular formula C28H37NO7 and a molecular weight of 499.6 g/mol. IUPAC name: (2S)-2-[5,7-dihydroxy-3-oxo-6-[(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1H-isoindol-2-yl]pentanedioic acid. InChIKey: LTEYADKCUWEHSA-GJUXQMEESA-N.

Identity
Molecular formulaC28H37NO7
Molecular weight499.6 g/mol
IUPAC name(2S)-2-[5,7-dihydroxy-3-oxo-6-[(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1H-isoindol-2-yl]pentanedioic acid
InChIKeyLTEYADKCUWEHSA-GJUXQMEESA-N
SMILESCC(=CCC/C(=C/CC/C(=C\CC1=C(C=C2C(=C1O)CN(C2=O)[C@@H](CCC(=O)O)C(=O)O)O)/C)/C)C

Computed by PubChem (NCBI)

Isomers (same molecular formula)
4-ethylmorpholine;bis(4-(4-methylphenyl)-4-oxobutanoic acid) C28H37NO7
4-(azulen-2-ylmethyl)-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenolate;2-hydroxyethyl(trimethyl)azanium C28H37NO7
[(1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] 3,5-diethyl-1,2-oxazole-4-carboxylate C28H37NO7