7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol
TL;DR: 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol (CAS 129051-72-5) is a chemical compound with molecular formula C27H29FO12 and molecular weight 564.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(1,2-dihydroxyethyl)-7-[(2R,3R,4R,5S,6S)-3-fluoro-4,5-dihydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol, 9-(1,2-dihydroxyethyl)-7-[(2R,3R,4R,5S,6S)-3-fluoro-4,5-dihydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione, 10-((2,6-Dideoxy-2-fluoro-alpha-L-talopyranosyl)oxy)-8-(1,2-dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione, (2S)-6-Fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene, 5,12-Naphthacenedione, 10-((2,6-dideoxy-2-fluoro-alpha-L-talopyranosyl)oxy)-8-(1,2-dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-
| Molecular Formula | C27H29FO12 |
|---|---|
| Molecular Weight | 564.16 g/mol |
| LogP | -0.2253 |
| Topological Polar Surface Area | 203.44 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 564.1643 |
| Heavy Atoms | 40 |
| Complexity | 1378.0131 |
Chemical Identifiers
| CAS Number | 129051-72-5 |
|---|---|
| SMILES | C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(CO)O)O)F)O)O |
Product Overview
7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol (CAS 129051-72-5), with molecular formula C27H29FO12 and molecular weight 564.16 g/mol. IUPAC: 9-(1,2-dihydroxyethyl)-7-[(2R,3R,4R,5S,6S)-3-fluoro-4,5-dihydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol
Property Insights of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol
The XLogP value of -0.2253 indicates that 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 203.44 Ų indicates high polarity, suggesting 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol has 7 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 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol?
The CAS number of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol is 129051-72-5.
What is the molecular formula of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol?
The molecular formula of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol is C27H29FO12.
What is the molecular weight of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol?
The molecular weight of 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol is 564.16 g/mol.
Where can I buy 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol?
You can request a quote for 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol?
Yes, KEHONG BIO provides custom synthesis services for 7-O-(2,6-Dideoxy-2-fluro-alpha-talopyranosyl)adriamycinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.