3-epi-Ochratoxin A-d5

CAS: 1177316-02-7

Ref. TR-O148497

Product Information

• Name: 3-epi-Ochratoxin A-d5
• Synonyms: 3S,14S-Ochratoxin A-d5, N-[[(3S)-5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-L-phenylalanine-d5
• Brand: TRC
• Description: Applications Epimer of Ochratoxin A (O148490), an toxic metabolites from Aspergillus orchraceus. Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the packageReferences Belli, N., et al.: Int. J. Food Microb., 96, 19 ( 2004), Pardo, E., et al.: Food Microb., 23, 35 (2006),

Chemical properties

• Molecular weight: 408.84
• Formula: C₂₀H₁₃D₅ClNO₆
• Color/Form: White To Off-White
• InChI: InChI=1S/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26)/t10-,15-/m0/s1/i2D,3D,4D,5D,6D
• InChI key: InChIKey=RWQKHEORZBHNRI-JYRICJBVSA-N
• SMILES: [2H]c1c([2H])c([2H])c(C[C@H](NC(=O)c2cc(Cl)c3c(c2O)C(=O)O[C@@H](C)C3)C(=O)O)c([2H])c1[2H]