1-Hydroxy-13-dihydrodaunomycin
TL;DR: 1-Hydroxy-13-dihydrodaunomycin (CAS 74273-36-2) is a chemical compound with molecular formula C27H31NO11 and molecular weight 545.19 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-1,6,9,11-tetrahydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: 1-Hydroxy-13-dihydrodaunomycin, 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-1,6,9,11-tetrahydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione, 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-7-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-9-(1-hydroxyethyl)-4-methoxy-1,6,9,11-tetrahydroxy-, 5,12-Naphthacenedione, 7-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-1,6,9,11-tetrahydroxy-9-(1-hydroxyethyl)-4-methoxy-, 3,5,7,12-Tetrahydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside
| Molecular Formula | C27H31NO11 |
|---|---|
| Molecular Weight | 545.19 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 545.1897 |
| Heavy Atoms | 39 |
| Complexity | 951.0 |
Chemical Identifiers
| CAS Number | 74273-36-2 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C=CC(=C5C4=O)OC)O)O)(C(C)O)O)N)O |
| InChIKey | BYWXYBOMWRGTBD-UHFFFAOYSA-N |
Product Overview
1-Hydroxy-13-dihydrodaunomycin (CAS 74273-36-2), with molecular formula C27H31NO11 and molecular weight 545.19 g/mol. IUPAC: 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-1,6,9,11-tetrahydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of 1-Hydroxy-13-dihydrodaunomycin
Property Insights of 1-Hydroxy-13-dihydrodaunomycin
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hydroxy-13-dihydrodaunomycin. The TPSA of 209.0 Ų indicates high polarity, suggesting 1-Hydroxy-13-dihydrodaunomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Hydroxy-13-dihydrodaunomycin 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 1-Hydroxy-13-dihydrodaunomycin?
The CAS number of 1-Hydroxy-13-dihydrodaunomycin is 74273-36-2.
What is the molecular formula of 1-Hydroxy-13-dihydrodaunomycin?
The molecular formula of 1-Hydroxy-13-dihydrodaunomycin is C27H31NO11.
What is the molecular weight of 1-Hydroxy-13-dihydrodaunomycin?
The molecular weight of 1-Hydroxy-13-dihydrodaunomycin is 545.19 g/mol.
Where can I buy 1-Hydroxy-13-dihydrodaunomycin?
You can request a quote for 1-Hydroxy-13-dihydrodaunomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-13-dihydrodaunomycin?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-13-dihydrodaunomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.