4'-Deoxymycaminosyltylonolide
TL;DR: 4'-Deoxymycaminosyltylonolide (CAS 80240-61-5) is a chemical compound with molecular formula C31H51NO9 and molecular weight 581.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4R,5S,6S,7R,9R,11E,13E,15R,16R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-(hydroxymethyl)-5,9,13-trimethyl-2,10-dioxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
Also Known As: Izenamicin B(sub 3), 4'-Deoxymycaminosyltylonolide, 4'-Deoxymycaminosyl tylonolide, Antibiotic YS 02930K-D, 5-O-(4-deoxymycaminosyl)tylonolide
| Molecular Formula | C31H51NO9 |
|---|---|
| Molecular Weight | 581.36 g/mol |
| LogP | 2.4316 |
| Topological Polar Surface Area | 142.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 581.3564 |
| Heavy Atoms | 41 |
| Complexity | 919.2646 |
Chemical Identifiers
| CAS Number | 80240-61-5 |
|---|---|
| SMILES | CC[C@@H]1[C@H](/C=C(/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)CC=O)C)\C)CO |
Product Overview
4'-Deoxymycaminosyltylonolide (CAS 80240-61-5), with molecular formula C31H51NO9 and molecular weight 581.36 g/mol. IUPAC: 2-[(4R,5S,6S,7R,9R,11E,13E,15R,16R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-(hydroxymethyl)-5,9,13-trimethyl-2,10-dioxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde.
Chemical Property Profile of 4'-Deoxymycaminosyltylonolide
Property Insights of 4'-Deoxymycaminosyltylonolide
The XLogP value of 2.4316 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Deoxymycaminosyltylonolide. The TPSA of 142.83 Ų indicates high polarity, suggesting 4'-Deoxymycaminosyltylonolide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4'-Deoxymycaminosyltylonolide has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-Deoxymycaminosyltylonolide?
The CAS number of 4'-Deoxymycaminosyltylonolide is 80240-61-5.
What is the molecular formula of 4'-Deoxymycaminosyltylonolide?
The molecular formula of 4'-Deoxymycaminosyltylonolide is C31H51NO9.
What is the molecular weight of 4'-Deoxymycaminosyltylonolide?
The molecular weight of 4'-Deoxymycaminosyltylonolide is 581.36 g/mol.
Where can I buy 4'-Deoxymycaminosyltylonolide?
You can request a quote for 4'-Deoxymycaminosyltylonolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Deoxymycaminosyltylonolide?
Yes, KEHONG BIO provides custom synthesis services for 4'-Deoxymycaminosyltylonolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.