Products 204853-33-8

CAS 204853-33-8 appears in our catalog under these names: (3S,4S,5S,6S)-3,4,5-Trihydroxy-6-(2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy)tetrahydro-2H-pyran-2-carboxylic acid, 97%, Tolcapone 3-beta-D-Glucuronide, Tolcapone 3-O-β-D-glucuronide, Tolcapone 3-β-D-glucuronide. Offered by: Chemat Brand, TRC, Chemat, MedChemExpress. Available pack sizes: on request, 10mg, 1mg, 2mg, 5mg, Get quote.

(3S,4S,5S,6S)-3,4,5-Trihydroxy-6-(2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy)tetrahydro-2H-pyran-2-carboxylic acid, 97%
Chemat Brand
  • size: on request
  • Variants: 1
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Tolcapone 3-beta-D-Glucuronide
Chemat Brand, TRC
  • size: on request, 10mg
  • Variants: 2
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Tolcapone 3-O-β-D-glucuronide
Chemat
  • size: 10mg, 1mg, 2mg, 5mg
  • Variants: 4
from 1731.66
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Tolcapone 3-β-D-glucuronide
MedChemExpress
  • size: Get quote
  • Variants: 1
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(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy]oxane-2-carboxylic acid (CAS 204853-33-8) is a chemical compound with the molecular formula C20H19NO11 and a molecular weight of 449.4 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy]oxane-2-carboxylic acid. InChIKey: QQQCXCUCFPMHBX-HBWRTXEVSA-N.

Identity
Molecular formulaC20H19NO11
Molecular weight449.4 g/mol
IUPAC name(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy]oxane-2-carboxylic acid
InChIKeyQQQCXCUCFPMHBX-HBWRTXEVSA-N
SMILESCC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)O)[N+](=O)[O-]

Computed by PubChem (NCBI)

Synonyms: Ro 61-1448, Tolcapone 3-|A-D-Glucuronide, Tolcapone 3-beta-D-Glucuronide, beta-D-Glucopyranosiduronic acid, 2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenyl, Tolcapone 3-?-D-Glucuronide, Tolcapone 3--D-Glucuronide, orb1986863, Tolcapone 3-O-beta-D-glucuronide, Tolcapone 3-O-beta-D-glucuronide, Min. 95%