AFLATOXIN M1
TL;DR: AFLATOXIN M1 (CAS 6795-23-9) is a chemical compound with molecular formula C17H12O7 and molecular weight 328.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,4,9,11,13(17)-pentaene-16,18-dione
Also Known As: AFLATOXIN M1, Aflatoxin M1-d3, 4-Hydroxyaflatoxin B1, 4-hydroxyaflatoxinb1 pound>>4-Hydroxyaflatoxin B1 pound>>AFM1, Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-9a-hydroxy-4-methoxy-
| Molecular Formula | C17H12O7 |
|---|---|
| Molecular Weight | 328.06 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.0583 |
| Heavy Atoms | 24 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 6795-23-9 |
|---|---|
| SMILES | COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C(=C1)OC5C4(C=CO5)O |
| InChIKey | MJBWDEQAUQTVKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AFLATOXIN M1 (CAS 6795-23-9), with molecular formula C17H12O7 and molecular weight 328.06 g/mol. IUPAC: 3-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,4,9,11,13(17)-pentaene-16,18-dione.
Chemical Property Profile of AFLATOXIN M1
Property Insights of AFLATOXIN M1
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AFLATOXIN M1. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AFLATOXIN M1. Following Lipinski's Rule of Five, AFLATOXIN M1 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AFLATOXIN M1?
The CAS number of AFLATOXIN M1 is 6795-23-9.
What is the molecular formula of AFLATOXIN M1?
The molecular formula of AFLATOXIN M1 is C17H12O7.
What is the molecular weight of AFLATOXIN M1?
The molecular weight of AFLATOXIN M1 is 328.06 g/mol.
Where can I buy AFLATOXIN M1?
You can request a quote for AFLATOXIN M1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AFLATOXIN M1?
Yes, KEHONG BIO provides custom synthesis services for AFLATOXIN M1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.