Atalanine
TL;DR: Atalanine (CAS 50906-85-9) is a chemical compound with molecular formula C34H30N2O9 and molecular weight 610.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R)-10-(4,8-dihydroxy-6-methoxy-10-methyl-9-oxoacridin-3-yl)oxy-1,5-dihydroxy-11-methyl-2-propan-2-yl-1,2-dihydrofuro[2,3-c]acridin-6-one
Also Known As: Atalanine, J2.408.769G, (1S,2R)-10-(4,8-dihydroxy-6-methoxy-10-methyl-9-oxoacridin-3-yl)oxy-1,5-dihydroxy-11-methyl-2-propan-2-yl-1,2-dihydrofuro[2,3-c]acridin-6-one, (1S,2R)-10-(4,8-dihydroxy-6-methoxy-10-methyl-9-oxo-acridin-3-yl)oxy-1,5-dihydroxy-2-isopropyl-11-methyl-1,2-dihydrofuro[2,3-c]acridin-6-one, (1S,2R)-10-[(4,8-Dihydroxy-6-methoxy-10-methyl-9-oxo-9,10-dihydroacridin-3-yl)oxy]-1,5-dihydroxy-11-methyl-2-(propan-2-yl)-1,11-dihydrofuro[2,3-c]acridin-6(2H)-one
| Molecular Formula | C34H30N2O9 |
|---|---|
| Molecular Weight | 610.20 g/mol |
| LogP | 5.0649 |
| Topological Polar Surface Area | 152.61 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 610.1951 |
| Heavy Atoms | 45 |
| Complexity | 2372.377 |
Chemical Identifiers
| CAS Number | 50906-85-9 |
|---|---|
| SMILES | CC(C)[C@@H]1[C@H](C2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4OC5=C(C6=C(C=C5)C(=O)C7=C(N6C)C=C(C=C7O)OC)O)C)O)O |
Product Overview
Atalanine (CAS 50906-85-9), with molecular formula C34H30N2O9 and molecular weight 610.20 g/mol. IUPAC: (1S,2R)-10-(4,8-dihydroxy-6-methoxy-10-methyl-9-oxoacridin-3-yl)oxy-1,5-dihydroxy-11-methyl-2-propan-2-yl-1,2-dihydrofuro[2,3-c]acridin-6-one.
Chemical Property Profile of Atalanine
Property Insights of Atalanine
The XLogP value of 5.0649 indicates that Atalanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.61 Ų indicates high polarity, suggesting Atalanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Atalanine has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Atalanine?
The CAS number of Atalanine is 50906-85-9.
What is the molecular formula of Atalanine?
The molecular formula of Atalanine is C34H30N2O9.
What is the molecular weight of Atalanine?
The molecular weight of Atalanine is 610.20 g/mol.
Where can I buy Atalanine?
You can request a quote for Atalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Atalanine?
Yes, KEHONG BIO provides custom synthesis services for Atalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.