Desacetyllankamycin
TL;DR: Desacetyllankamycin (CAS 33955-27-0) is a chemical compound with molecular formula C40H70O15 and molecular weight 790.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-hydroxy-2-(3-hydroxybutan-2-yl)-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-10-(3-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-6,14-dioxo-oxacyclotetradec-4-yl] acetate
Also Known As: Kujimycin A, Desacetyllankamycin, Deacetyllankamycin, 4'-O-Deacetyllankamycin, 4(sup A)-O-Deacetyl-lankamycin
| Molecular Formula | C40H70O15 |
|---|---|
| Molecular Weight | 790.47 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 790.4715 |
| Heavy Atoms | 55 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 33955-27-0 |
|---|---|
| SMILES | CC1CC(C(C(O1)OC2C(CC(C(=O)C(C(C(C(OC(=O)C(C(C2C)OC3CC(C(C(O3)C)O)(C)OC)C)C(C)C(C)O)C)OC(=O)C)C)(C)O)C)O)OC |
| InChIKey | XITHDKRNUSLORY-UHFFFAOYSA-N |
Product Overview
Desacetyllankamycin (CAS 33955-27-0), with molecular formula C40H70O15 and molecular weight 790.47 g/mol. IUPAC: [7-hydroxy-2-(3-hydroxybutan-2-yl)-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-10-(3-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-6,14-dioxo-oxacyclotetradec-4-yl] acetate.
Chemical Property Profile of Desacetyllankamycin
Property Insights of Desacetyllankamycin
The XLogP value of 3.4 indicates that Desacetyllankamycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 206.0 Ų indicates high polarity, suggesting Desacetyllankamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desacetyllankamycin has 4 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Desacetyllankamycin?
The CAS number of Desacetyllankamycin is 33955-27-0.
What is the molecular formula of Desacetyllankamycin?
The molecular formula of Desacetyllankamycin is C40H70O15.
What is the molecular weight of Desacetyllankamycin?
The molecular weight of Desacetyllankamycin is 790.47 g/mol.
Where can I buy Desacetyllankamycin?
You can request a quote for Desacetyllankamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desacetyllankamycin?
Yes, KEHONG BIO provides custom synthesis services for Desacetyllankamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.