Epoxykidamycin
TL;DR: Epoxykidamycin (CAS 6315-02-2) is a chemical compound with molecular formula C39H48N2O10 and molecular weight 704.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[4-(dimethylamino)-5-hydroxy-4,6-dimethyloxan-2-yl]-8-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-2-(2,3-dimethyloxiran-2-yl)-11-hydroxy-5-methylnaphtho[3,2-h]chromene-4,7,12-trione
Also Known As: Epoxykidamycin, 9-[4-(dimethylamino)-5-hydroxy-4,6-dimethyloxan-2-yl]-8-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-2-(2,3-dimethyloxiran-2-yl)-11-hydroxy-5-methylnaphtho[3,2-h]chromene-4,7,12-trione, 4H-Anthra(1,2-b)pyran-4,7,12-trione, 2-(2,3-dimethyloxiranyl)-11-hydroxy-5-methyl-8-(2,3,6-trideoxy-3-(dimethylamino)-beta-D-arabino-hexopyranosyl)-10-(2,3,6-trideoxy-3-(dimethylamino)-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-, 9-[4-(dimethylamino)-5-hydroxy-4,6-dimethyltetrahydro-2h-pyran-2-yl]-8-[4-(dimethylamino)-5-hydroxy-6-methyltetrahydro-2h-pyran-2-yl]-2-(2,3-dimethyloxiran-2-yl)-11-hydroxy-5-methyl-4h-naphtho[2,3-h]chromene-4,7,12-trione(non-preferred name), 9-(4-(dimethylamino)-5-hydroxy-4,6-dimethyloxan-2-yl)-8-(4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl)-2-(2,3-dimethyloxiran-2-yl)-11-hydroxy-5-methylnaphtho(3,2-h)chromene-4,7,12-trione
| Molecular Formula | C39H48N2O10 |
|---|---|
| Molecular Weight | 704.33 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 704.3309 |
| Heavy Atoms | 51 |
| Complexity | 1450.0 |
Chemical Identifiers
| CAS Number | 6315-02-2 |
|---|---|
| SMILES | CC1C(C(CC(O1)C2=C3C(=C(C=C2C4CC(C(C(O4)C)O)(C)N(C)C)O)C(=O)C5=C(C3=O)C=C(C6=C5OC(=CC6=O)C7(C(O7)C)C)C)N(C)C)O |
| InChIKey | PVJYYBPEVWDBNV-UHFFFAOYSA-N |
Product Overview
Epoxykidamycin (CAS 6315-02-2), with molecular formula C39H48N2O10 and molecular weight 704.33 g/mol. IUPAC: 9-[4-(dimethylamino)-5-hydroxy-4,6-dimethyloxan-2-yl]-8-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-2-(2,3-dimethyloxiran-2-yl)-11-hydroxy-5-methylnaphtho[3,2-h]chromene-4,7,12-trione.
Chemical Property Profile of Epoxykidamycin
Property Insights of Epoxykidamycin
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Epoxykidamycin. The TPSA of 159.0 Ų indicates high polarity, suggesting Epoxykidamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epoxykidamycin has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Epoxykidamycin?
The CAS number of Epoxykidamycin is 6315-02-2.
What is the molecular formula of Epoxykidamycin?
The molecular formula of Epoxykidamycin is C39H48N2O10.
What is the molecular weight of Epoxykidamycin?
The molecular weight of Epoxykidamycin is 704.33 g/mol.
Where can I buy Epoxykidamycin?
You can request a quote for Epoxykidamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epoxykidamycin?
Yes, KEHONG BIO provides custom synthesis services for Epoxykidamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.