Etoposide quinone
TL;DR: Etoposide quinone (CAS 114836-85-0) is a chemical compound with molecular formula C28H28O13 and molecular weight 572.153 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[5-[[(4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-3-methoxycyclohexa-3,5-diene-1,2-dione
Also Known As: Etoposide quinone, Etoposide o-Quinone, Etoposide 3',4'-Quinone, 5-[5-[[(4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-3-methoxycyclohexa-3,5-diene-1,2-dione, 9-(5-methoxy-3,4-dioxocyclohexa-1,5-dien-1-yl)-8-oxo-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 4,6-o-ethylidene-
Technical Specifications
| Molecular Formula | C28H28O13 |
| Molecular Weight | 572.153 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 166.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 572.153 Da |
| Heavy Atoms | 41 |
| Complexity | 1170.0 |
| SMILES | CC1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)OC3C4COC(=O)C4C(C5=CC6=C(C=C35)OCO6)C7=CC(=O)C(=O)C(=C7)OC)O)O |
| InChIKey | SBLYXIKLMHGUJZ-LBMXFXLMSA-N |
Chemical Property Profile of Etoposide quinone
Property Insights of Etoposide quinone
The XLogP value of -0.8 indicates that Etoposide quinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 166.0 Ų indicates high polarity, suggesting Etoposide quinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Etoposide quinone has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Etoposide quinone?
The CAS number of Etoposide quinone is 114836-85-0.
What is the molecular formula of Etoposide quinone?
The molecular formula of Etoposide quinone is C28H28O13.
What is the molecular weight of Etoposide quinone?
The molecular weight of Etoposide quinone is 572.153 g/mol.
Where can I buy Etoposide quinone?
You can request a quote for Etoposide quinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Etoposide quinone?
Yes, CoreyChem provides custom synthesis services for Etoposide quinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.