Anhydromaggiemycin
TL;DR: Anhydromaggiemycin (CAS 97416-98-3) is a chemical compound with molecular formula C22H16O8 and molecular weight 408.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-ethyl-4,5,7,12-tetrahydroxy-6,11-dioxotetracene-1-carboxylate
Also Known As: Anhydromaggiemycin, 1H-Perimidine,2-methyl-6-[(4-nitrophenyl)azo], methyl 2-ethyl-4,5,7,12-tetrahydroxy-6,11-dioxo-6,11-dihydrotetracene-1-carboxylate, methyl 2-ethyl-4,5,7,12-tetrahydroxy-6,11-dioxotetracene-1-carboxylate, 1-Naphthacenecarboxylic acid, 2-ethyl-6,11-dihydro-4,5,7,12-tetrahydroxy-6,11-dioxo-, methyl ester
| Molecular Formula | C22H16O8 |
|---|---|
| Molecular Weight | 408.08 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.0845 |
| Heavy Atoms | 30 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 97416-98-3 |
|---|---|
| SMILES | CCC1=CC(=C2C(=C1C(=O)OC)C(=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)O)O |
| InChIKey | UUAGKLUSYOOORZ-UHFFFAOYSA-N |
Product Overview
Anhydromaggiemycin (CAS 97416-98-3), with molecular formula C22H16O8 and molecular weight 408.08 g/mol. IUPAC: methyl 2-ethyl-4,5,7,12-tetrahydroxy-6,11-dioxotetracene-1-carboxylate.
Chemical Property Profile of Anhydromaggiemycin
Property Insights of Anhydromaggiemycin
The XLogP value of 5.0 indicates that Anhydromaggiemycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting Anhydromaggiemycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Anhydromaggiemycin has 4 hydrogen bond donor(s) and 8 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 Anhydromaggiemycin?
The CAS number of Anhydromaggiemycin is 97416-98-3.
What is the molecular formula of Anhydromaggiemycin?
The molecular formula of Anhydromaggiemycin is C22H16O8.
What is the molecular weight of Anhydromaggiemycin?
The molecular weight of Anhydromaggiemycin is 408.08 g/mol.
Where can I buy Anhydromaggiemycin?
You can request a quote for Anhydromaggiemycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anhydromaggiemycin?
Yes, KEHONG BIO provides custom synthesis services for Anhydromaggiemycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.