Products 819802-34-1

CAS 819802-34-1 appears in our catalog under these names: 3-Demethyl Thiocolchicine 3-O-Beta-D-Glucuronide, >95% (HPLC), 3-Desmethylthiocolchicine-3-O-D-glucuronide. Offered by: TRC, Biosynth. Available pack sizes: 5mg, 2mg, 10mg.

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

(2R,3R,4R,5S,6R)-6-[[(7S)-7-acetamido-1,2-dimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 819802-34-1) is a chemical compound with the molecular formula C27H31NO11S and a molecular weight of 577.6 g/mol. IUPAC name: (2R,3R,4R,5S,6R)-6-[[(7S)-7-acetamido-1,2-dimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: JJEHAQVFBUIDIV-IMCCAWCASA-N.

Identity
Molecular formulaC27H31NO11S
Molecular weight577.6 g/mol
IUPAC name(2R,3R,4R,5S,6R)-6-[[(7S)-7-acetamido-1,2-dimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyJJEHAQVFBUIDIV-IMCCAWCASA-N
SMILESCC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)O[C@@H]4[C@H]([C@@H]([C@H]([C@@H](O4)C(=O)O)O)O)O

Computed by PubChem (NCBI)