Products 1177316-02-7

CAS 1177316-02-7 appears in our catalog under these names: 3-epi-Ochratoxin A-d5, >95% (HPLC), 3-epi-Ochratoxin A-d5. Offered by: TRC, MedChemExpress. Available pack sizes: 0,5mg, 1mg, 5mg, 5 mg, 1 mg, 500 μg.

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

(2S)-2-[[(3S)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid (CAS 1177316-02-7) is a chemical compound with the molecular formula C20H18ClNO6 and a molecular weight of 408.8 g/mol. IUPAC name: (2S)-2-[[(3S)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid. InChIKey: RWQKHEORZBHNRI-JYRICJBVSA-N.

Identity
Molecular formulaC20H18ClNO6
Molecular weight408.8 g/mol
IUPAC name(2S)-2-[[(3S)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid
InChIKeyRWQKHEORZBHNRI-JYRICJBVSA-N
SMILES[2H]C1=C(C(=C(C(=C1[2H])[2H])C[C@@H](C(=O)O)NC(=O)C2=CC(=C3C[C@@H](OC(=O)C3=C2O)C)Cl)[2H])[2H]

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