Desacetyladriamycin
TL;DR: Desacetyladriamycin (CAS 64870-36-6) is a chemical compound with molecular formula C25H27NO9 and molecular weight 485.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,8,11-trihydroxy-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione
Also Known As: Desacetyladriamycin, 9-epi-Deacetydaunorubicin, (8R-trans)-10-((3-Amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione, 5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8R-trans)-, 10- oxy-6,8,11-trihydroxy-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione
| Molecular Formula | C25H27NO9 |
|---|---|
| Molecular Weight | 485.17 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 485.16858 |
| Heavy Atoms | 35 |
| Complexity | 825.0 |
Chemical Identifiers
| CAS Number | 64870-36-6 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)O)N)O |
| InChIKey | PILBYTNNIUDJPF-UHFFFAOYSA-N |
Product Overview
Desacetyladriamycin (CAS 64870-36-6), with molecular formula C25H27NO9 and molecular weight 485.17 g/mol. IUPAC: 10-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,8,11-trihydroxy-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione.
Chemical Property Profile of Desacetyladriamycin
Property Insights of Desacetyladriamycin
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desacetyladriamycin. The TPSA of 169.0 Ų indicates high polarity, suggesting Desacetyladriamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desacetyladriamycin has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Desacetyladriamycin?
The CAS number of Desacetyladriamycin is 64870-36-6.
What is the molecular formula of Desacetyladriamycin?
The molecular formula of Desacetyladriamycin is C25H27NO9.
What is the molecular weight of Desacetyladriamycin?
The molecular weight of Desacetyladriamycin is 485.17 g/mol.
Where can I buy Desacetyladriamycin?
You can request a quote for Desacetyladriamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desacetyladriamycin?
Yes, KEHONG BIO provides custom synthesis services for Desacetyladriamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.