Aflatoxin M1-(O-carboxymethyl)oxime
TL;DR: Aflatoxin M1-(O-carboxymethyl)oxime (CAS 127862-46-8) is a chemical compound with molecular formula C19H15NO9 and molecular weight 401.07468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-[(3R,7R)-3-hydroxy-11-methoxy-18-oxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,4,9,11,13(17)-pentaen-16-ylidene]amino]oxyacetic acid
Also Known As: Afmocm, Aflatoxin M1-(O-carboxymethyl)oxime, (6aR-cis)-(((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)acetic acid, 2-[(E)-[(3R,7R)-3-hydroxy-11-methoxy-18-oxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,4,9,11,13(17)-pentaen-16-ylidene]amino]oxyacetic acid, 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)-
Technical Specifications
| Molecular Formula | C19H15NO9 |
| Molecular Weight | 401.07468 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.07468 Da |
| Heavy Atoms | 29 |
| Complexity | 849.0 |
| SMILES | COC1=C2C3=C(/C(=N/OCC(=O)O)/CC3)C(=O)OC2=C4C(=C1)O[C@@H]5[C@]4(C=CO5)O |
| InChIKey | KDQXYCUSOMGQMS-CXHUKFPDSA-N |
Chemical Property Profile of Aflatoxin M1-(O-carboxymethyl)oxime
Property Insights of Aflatoxin M1-(O-carboxymethyl)oxime
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aflatoxin M1-(O-carboxymethyl)oxime. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aflatoxin M1-(O-carboxymethyl)oxime. Following Lipinski's Rule of Five, Aflatoxin M1-(O-carboxymethyl)oxime has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Aflatoxin M1-(O-carboxymethyl)oxime?
The CAS number of Aflatoxin M1-(O-carboxymethyl)oxime is 127862-46-8.
What is the molecular formula of Aflatoxin M1-(O-carboxymethyl)oxime?
The molecular formula of Aflatoxin M1-(O-carboxymethyl)oxime is C19H15NO9.
What is the molecular weight of Aflatoxin M1-(O-carboxymethyl)oxime?
The molecular weight of Aflatoxin M1-(O-carboxymethyl)oxime is 401.07468 g/mol.
Where can I buy Aflatoxin M1-(O-carboxymethyl)oxime?
You can request a quote for Aflatoxin M1-(O-carboxymethyl)oxime directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aflatoxin M1-(O-carboxymethyl)oxime?
Yes, CoreyChem provides custom synthesis services for Aflatoxin M1-(O-carboxymethyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.