OCHRATOXIN A

Molecular Formula: C₂₀H₁₈ClNO₆

InChI: InChI=1/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)/f/h22,25H

InChIKey: InChIKey=RWQKHEORZBHNRI-WKAABZQDCW
SMILES: CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)O)Cl

Names:
    Alanine, N-[ (5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl]-3-p henyl-, (-)-
    Antibiotic 9663
    L-Phenylalanine, N-[ (5-chloro-3, 4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]- , (R)-
    NSC221991
    OCHRATOXIN A
    (R)N-(5-Chloro-3, 4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)phenylalan ine
    2-[(5-chloro-8-hydroxy-3-methyl-1-oxo-isochroman-7-carbonyl)amino]-3-phenyl-propanoic acid
    303-47-9

Registries:
    PubChem CID 4580
    PubChem ID 130503