14-carminomycyl-N-pyridinium
TL;DR: 14-carminomycyl-N-pyridinium (CAS 110508-99-1) is a chemical compound with molecular formula C31H31BrN2O10 and molecular weight 670.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-4,6,9,11-tetrahydroxy-9-(2-pyridin-1-ium-1-ylacetyl)-8,10-dihydro-7H-tetracene-5,12-dione bromide
Also Known As: 14-Carminomycyl-N-pyridinium, 14-Carminomycyl-N-pyridinium bromide, Quinoline,2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-6-methoxy-4-methyl, 3,5,10,12-tetrahydroxy-6,11-dioxo-3-(pyridinium-1-ylacetyl)-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside bromide, 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-4,6,9,11-tetrahydroxy-9-(2-pyridin-1-ium-1-ylacetyl)-8,10-dihydro-7H-tetracene-5,12-dione bromide
| Molecular Formula | C31H31BrN2O10 |
|---|---|
| Molecular Weight | 670.12 g/mol |
| LogP | -2.3023 |
| Topological Polar Surface Area | 201.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 670.1162 |
| Heavy Atoms | 44 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 110508-99-1 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)O)O)(C(=O)C[N+]6=CC=CC=C6)O)N)O.[Br-] |
| InChIKey | HOGZQUMZIYVPAR-UHFFFAOYSA-N |
Product Overview
14-carminomycyl-N-pyridinium (CAS 110508-99-1), with molecular formula C31H31BrN2O10 and molecular weight 670.12 g/mol. IUPAC: 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-4,6,9,11-tetrahydroxy-9-(2-pyridin-1-ium-1-ylacetyl)-8,10-dihydro-7H-tetracene-5,12-dione bromide.
Chemical Property Profile of 14-carminomycyl-N-pyridinium
Property Insights of 14-carminomycyl-N-pyridinium
The XLogP value of -2.3023 indicates that 14-carminomycyl-N-pyridinium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 201.0 Ų indicates high polarity, suggesting 14-carminomycyl-N-pyridinium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 14-carminomycyl-N-pyridinium has 6 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 14-carminomycyl-N-pyridinium?
The CAS number of 14-carminomycyl-N-pyridinium is 110508-99-1.
What is the molecular formula of 14-carminomycyl-N-pyridinium?
The molecular formula of 14-carminomycyl-N-pyridinium is C31H31BrN2O10.
What is the molecular weight of 14-carminomycyl-N-pyridinium?
The molecular weight of 14-carminomycyl-N-pyridinium is 670.12 g/mol.
Where can I buy 14-carminomycyl-N-pyridinium?
You can request a quote for 14-carminomycyl-N-pyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 14-carminomycyl-N-pyridinium?
Yes, KEHONG BIO provides custom synthesis services for 14-carminomycyl-N-pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.