Aflatoxin M1-(O-Carboxymethyl)Oxime
[CAS# 127862-46-8]

Identification

• Name: Aflatoxin M1-(O-Carboxymethyl)Oxime
• Synonyms: Acetic Acid, (((3,6A,9A,11-Tetrahydro-9A-Hydroxy-4-Methoxy-11-Oxocyclopenta(C)Furo(3',2':4,5)Furo(2,3-H)(1)Benzopyran-1(2H)-Ylidene)Amino)Oxy)-, (6Ar-Cis)-; Aflatoxin M1-(O-Carboxymethyl)Oxime; Afmocm
• Molecular Formula: C₁₉H₁₅NO₉
• Molecular Weight: 401.33
• CAS Registry Number: 127862-46-8
• SMILES: [C@]34(O)C2=C1OC(=O)C5=C(C1=C(OC)C=C2O[C@H]3OC=C4)CC\C5=N/OCC(=O)O
• InChI: 1S/C19H15NO9/c1-25-10-6-11-15(19(24)4-5-26-18(19)28-11)16-14(10)8-2-3-9(13(8)17(23)29-16)20-27-7-12(21)22/h4-6,18,24H,2-3,7H2,1H3,(H,21,22)/b20-9+/t18-,19-/m1/s1
• InChIKey: KDQXYCUSOMGQMS-CXHUKFPDSA-N

Properties

• Density: 1.772g/cm³ (Cal.)
• Boiling point: 747.193°C at 760 mmHg (Cal.)
• Flash point: 405.688°C (Cal.)