3-(N-Acetyl-L-cystein-S-yl) Acetaminophen

cas: 52372-86-8 — see every product listed under this CAS number, including other names

3-(N-Acetyl-L-cystein-S-yl) Acetaminophen (CAS 52372-86-8) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 10mg, 25mg, 50mg. Offered by: Biosynth.

brandBiosynth
catalog numberCCA37286-5mg
cas52372-86-8
size5mg
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properties

categoryControlled Products
purityNo data
delivery time3-4 Weeks
Structural formula: {0} (CAS {1})

S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine is an S-substituted N-acetyl-L-cysteine in which the S-substitutuent is specified as 5-acetamido-2-hydroxyphenyl. It has a role as a drug metabolite, a human urinary metabolite and a rat metabolite. It is an organic sulfide, a member of acetamides, a member of phenols and a S-substituted N-acetyl-L-cysteine. It is functionally related to a paracetamol. It is a conjugate acid of a S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteinate.

Source: ChEBI

Identity
Molecular formulaC13H16N2O5S
Molecular weight312.34 g/mol
IUPAC name(2R)-2-acetamido-3-(5-acetamido-2-hydroxyphenyl)sulfanylpropanoic acid
InChIKeyDVPRQNKJGQEICH-JTQLQIEISA-N
SMILESCC(=O)NC1=CC(=C(C=C1)O)SC[C@@H](C(=O)O)NC(=O)C

Computed by PubChem (NCBI)

Synonyms: Acetaminophen mercapturate, l-Cysteine, N-acetyl-S-[5-(acetylamino)-2-hydroxyphenyl]-, N-Acetyl-S-(5-(acetylamino)-2-hydroxyphenyl)-L-cysteine, N-Acetyl-S-[5-(acetylamino)-2-hydroxyphenyl]-L-Cysteine, L-Cysteine, N-acetyl-S-(5-(acetylamino)-2-hydroxyphenyl)-, 3-(N-acetyl-L-cystein-S-yl) acetaminophen, Acetaminophen-2-mercapturate, S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine, (2R)-2-acetamido-3-(5-acetamido-2-hydroxyphenyl)sulfanylpropanoic acid, acetaminophen mercapturic acid
Isomers (same molecular formula)
4-(4-acetylpiperazin-1-yl)sulfonylbenzoic acid C13H16N2O5S
1-hydroxy-2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)propane-2-sulfonic acid C13H16N2O5S
2-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonylamino]acetic acid C13H16N2O5S
1-(4-carbamoylphenyl)sulfonylpiperidine-4-carboxylic acid C13H16N2O5S
4-N-(4-methoxyphenyl)benzene-1,4-diamine;sulfuric acid C13H16N2O5S
1-(4-acetamidophenyl)sulfonylpyrrolidine-2-carboxylic acid C13H16N2O5S
methyl 5-(3-hydroxyprop-1-ynyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazole-4-carboxylate C13H16N2O5S
(5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(5-oxopyrrolidin-2-yl)methyl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid C13H16N2O5S
4-N-(4-methoxyphenyl)benzene-1,4-diamine;sulfuric acid C13H16N2O5S
3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propanoic acid C13H16N2O5S
benzyl 1,1-dioxo-3a,4,6,7-tetrahydro-3H-oxathiazolo[3,4-a]pyrazine-5-carboxylate C13H16N2O5S
(5R,6R)-3-[(E)-2-acetamidoethenyl]sulfanyl-6-[(1S)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid C13H16N2O5S

Also listed as

Acetaminophen Mercapturate Chemat Brand CAS 52372-86-8
3-(N-Acetyl-L-cystein-S-yl) Acetaminophen, >95% (HPLC) TRC CAS 52372-86-8