Antibiotic MA 144U5
TL;DR: Antibiotic MA 144U5 (CAS 65222-72-2) is a chemical compound with molecular formula C40H48O16 and molecular weight 784.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,2R,4S)-2-ethyl-2,5,7-trihydroxy-4-[(2R,4S,5S,6S)-4-hydroxy-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2R,6R)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
Also Known As: Antibiotic MA 144U5, MA 144U5, 1-Naphthacenecarboxylic acid, 4-((2,6-dideoxy-4-O-(2,6-dideoxy-4-O-((2R-trans)-tetrahydro-6-methyl-5-oxo-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-, methyl ester, (1R-(1alpha,2beta,4beta))-, Methyl (1R-(1alpha,2beta,4beta))-4-((2,6-dideoxy-4-O-(2,6-dideoxy-4-O-((2R-trans)-tetrahydro-6-methyl-5-oxo-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-1-naphthacenecarboxylate, methyl (1R,2R,4S)-2-ethyl-2,5,7-trihydroxy-4-[(2R,4S,5S,6S)-4-hydroxy-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2R,6R)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
| Molecular Formula | C40H48O16 |
|---|---|
| Molecular Weight | 784.29 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 234.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 784.29425 |
| Heavy Atoms | 56 |
| Complexity | 1480.0 |
Chemical Identifiers
| CAS Number | 65222-72-2 |
|---|---|
| SMILES | CC[C@]1(C[C@@H](C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C3=O)C(=CC=C4)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CCC(=O)[C@H](O7)C)O)O)O |
| InChIKey | GETZZXKOBLIOQR-ZMHOUKOOSA-N |
Product Overview
Antibiotic MA 144U5 (CAS 65222-72-2), with molecular formula C40H48O16 and molecular weight 784.29 g/mol. IUPAC: methyl (1R,2R,4S)-2-ethyl-2,5,7-trihydroxy-4-[(2R,4S,5S,6S)-4-hydroxy-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2R,6R)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate.
Chemical Property Profile of Antibiotic MA 144U5
Property Insights of Antibiotic MA 144U5
The XLogP value of 3.1 indicates that Antibiotic MA 144U5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 234.0 Ų indicates high polarity, suggesting Antibiotic MA 144U5 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Antibiotic MA 144U5 has 5 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Antibiotic MA 144U5?
The CAS number of Antibiotic MA 144U5 is 65222-72-2.
What is the molecular formula of Antibiotic MA 144U5?
The molecular formula of Antibiotic MA 144U5 is C40H48O16.
What is the molecular weight of Antibiotic MA 144U5?
The molecular weight of Antibiotic MA 144U5 is 784.29 g/mol.
Where can I buy Antibiotic MA 144U5?
You can request a quote for Antibiotic MA 144U5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibiotic MA 144U5?
Yes, KEHONG BIO provides custom synthesis services for Antibiotic MA 144U5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.