Products 1356840-94-2

CAS 1356840-94-2 is the registry number for Ochratoxin C-d5. Offered by: TRC. Available pack sizes: 0,25mg, 2,5mg.

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

Ethyl (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoate (CAS 1356840-94-2) is a chemical compound with the molecular formula C22H22ClNO6 and a molecular weight of 436.9 g/mol. IUPAC name: ethyl (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoate. InChIKey: BPZZWRPHVVDAPT-ACKYJMHYSA-N.

Identity
Molecular formulaC22H22ClNO6
Molecular weight436.9 g/mol
IUPAC nameethyl (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoate
InChIKeyBPZZWRPHVVDAPT-ACKYJMHYSA-N
SMILES[2H]C1=C(C(=C(C(=C1[2H])[2H])C[C@@H](C(=O)OCC)NC(=O)C2=CC(=C3C[C@H](OC(=O)C3=C2O)C)Cl)[2H])[2H]

Computed by PubChem (NCBI)

Synonyms: Ochratoxin C-d5