Products 1204819-92-0

CAS 1204819-92-0 appears in our catalog under these names: PNU–159682 carboxylic acid, PNU-159682 carboxylic acid, 92.02%, 92.02%, PNU-159682 carboxylic acid, 92.02%. Offered by: GLPBio, Chemat, MedChemExpress. Available pack sizes: 10mg, 50mg, 1mg, 50 mg, 25 mg, 1 mg, 100 mg, 10mM/1mL.

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

(2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid (CAS 1204819-92-0) is a chemical compound with the molecular formula C31H33NO13 and a molecular weight of 627.6 g/mol. IUPAC name: (2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid. InChIKey: QRJDFOACHALIRS-LURYFDOKSA-N.

Identity
Molecular formulaC31H33NO13
Molecular weight627.6 g/mol
IUPAC name(2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid
InChIKeyQRJDFOACHALIRS-LURYFDOKSA-N
SMILESC[C@H]1[C@@H]2[C@H](C[C@@H](O1)O[C@H]3C[C@@](CC4=C3C(=C5C(=C4O)C(=O)C6=C(C5=O)C(=CC=C6)OC)O)(C(=O)O)O)N7CCO[C@@H]([C@H]7O2)OC

Computed by PubChem (NCBI)