N-Acetyl-13-dihydrodaunomycin
TL;DR: N-Acetyl-13-dihydrodaunomycin (CAS 6318-10-1) is a chemical compound with molecular formula C29H33NO11 and molecular weight 571.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-hydroxy-2-methyl-6-[[3,5,12-trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]acetamide
Also Known As: N-Acetyldaunorubicinol, N-Acetyl-13-dihydrodaunomycin, N-[3-hydroxy-2-methyl-6-[[3,5,12-trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]acetamide, N-[3-hydroxy-2-methyl-6-[[3,5,12-trihydroxy-3-(1-hydroxyethy, 3,5,12-Trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-[(1-hydroxyethylidene)amino]hexopyranoside
| Molecular Formula | C29H33NO11 |
|---|---|
| Molecular Weight | 571.21 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 571.2054 |
| Heavy Atoms | 41 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 6318-10-1 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(C)O)O)NC(=O)C)O |
| InChIKey | IFWQBDPCFWWVSC-UHFFFAOYSA-N |
Product Overview
N-Acetyl-13-dihydrodaunomycin (CAS 6318-10-1), with molecular formula C29H33NO11 and molecular weight 571.21 g/mol. IUPAC: N-[3-hydroxy-2-methyl-6-[[3,5,12-trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]acetamide.
Chemical Property Profile of N-Acetyl-13-dihydrodaunomycin
Property Insights of N-Acetyl-13-dihydrodaunomycin
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetyl-13-dihydrodaunomycin. The TPSA of 192.0 Ų indicates high polarity, suggesting N-Acetyl-13-dihydrodaunomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Acetyl-13-dihydrodaunomycin has 6 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 N-Acetyl-13-dihydrodaunomycin?
The CAS number of N-Acetyl-13-dihydrodaunomycin is 6318-10-1.
What is the molecular formula of N-Acetyl-13-dihydrodaunomycin?
The molecular formula of N-Acetyl-13-dihydrodaunomycin is C29H33NO11.
What is the molecular weight of N-Acetyl-13-dihydrodaunomycin?
The molecular weight of N-Acetyl-13-dihydrodaunomycin is 571.21 g/mol.
Where can I buy N-Acetyl-13-dihydrodaunomycin?
You can request a quote for N-Acetyl-13-dihydrodaunomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl-13-dihydrodaunomycin?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-13-dihydrodaunomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.