Tetracenomycin C
TL;DR: Tetracenomycin C (CAS 71135-22-3) is a chemical compound with molecular formula C23H20O11 and molecular weight 472.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-7H-tetracene-2-carboxylate
Also Known As: Tetracenomycin C, Tetracenomycin, methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-6,6a,7,10,10a,11-hexahydrotetracene-2-carboxylate, methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-7H-tetracene-2-carboxylate, 2-Naphthacenecarboxylic acid, 6,6a,7,10,10a,11-hexahydro-6a,10a,12,?-tetrahydroxy-3,?-dimethoxy-1-methyl-6,11,?-trioxo-, methyl ester
| Molecular Formula | C23H20O11 |
|---|---|
| Molecular Weight | 472.10 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 177.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.10056 |
| Heavy Atoms | 34 |
| Complexity | 959.0 |
Chemical Identifiers
| CAS Number | 71135-22-3 |
|---|---|
| SMILES | CC1=C(C(=CC2=CC3=C(C(=C12)O)C(=O)[C@@]4(C(=O)C=C([C@H]([C@@]4(C3=O)O)O)OC)O)OC)C(=O)OC |
| InChIKey | ULHJWHCSSAEMLW-UEVCKROQSA-N |
Product Overview
Tetracenomycin C (CAS 71135-22-3), with molecular formula C23H20O11 and molecular weight 472.10 g/mol. IUPAC: methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-7H-tetracene-2-carboxylate.
Chemical Property Profile of Tetracenomycin C
Property Insights of Tetracenomycin C
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetracenomycin C. The TPSA of 177.0 Ų indicates high polarity, suggesting Tetracenomycin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetracenomycin C has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetracenomycin C?
The CAS number of Tetracenomycin C is 71135-22-3.
What is the molecular formula of Tetracenomycin C?
The molecular formula of Tetracenomycin C is C23H20O11.
What is the molecular weight of Tetracenomycin C?
The molecular weight of Tetracenomycin C is 472.10 g/mol.
Where can I buy Tetracenomycin C?
You can request a quote for Tetracenomycin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetracenomycin C?
Yes, KEHONG BIO provides custom synthesis services for Tetracenomycin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.