Megalomycin C1
TL;DR: Megalomycin C1 (CAS 49669-76-3) is a chemical compound with molecular formula C48H84N2O17 and molecular weight 960.58 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-acetyloxy-6-[[6,7-bis[[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy]-14-ethyl-12,13-dihydroxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-4-yl]oxy]-2,4-dimethyloxan-3-yl] acetate
Also Known As: Megalomycin C1, Megalomicin C1, Antibiotic XK 41A2, 3',4'-Diacetylmegalomycin A, XK-41-A2
| Molecular Formula | C48H84N2O17 |
|---|---|
| Molecular Weight | 960.58 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 239.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 13 |
| Exact Mass | 960.577 |
| Heavy Atoms | 67 |
| Complexity | 1690.0 |
Chemical Identifiers
| CAS Number | 49669-76-3 |
|---|---|
| SMILES | CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)OC(=O)C)(C)OC(=O)C)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OC4C(C(CC(O4)C)N(C)C)O)C)C)O)(C)O |
| InChIKey | AOCKNXLGBSUHIQ-UHFFFAOYSA-N |
Product Overview
Megalomycin C1 (CAS 49669-76-3), with molecular formula C48H84N2O17 and molecular weight 960.58 g/mol. IUPAC: [4-acetyloxy-6-[[6,7-bis[[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy]-14-ethyl-12,13-dihydroxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-4-yl]oxy]-2,4-dimethyloxan-3-yl] acetate.
Chemical Property Profile of Megalomycin C1
Property Insights of Megalomycin C1
The XLogP value of 3.8 indicates that Megalomycin C1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 239.0 Ų indicates high polarity, suggesting Megalomycin C1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Megalomycin C1 has 4 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Megalomycin C1?
The CAS number of Megalomycin C1 is 49669-76-3.
What is the molecular formula of Megalomycin C1?
The molecular formula of Megalomycin C1 is C48H84N2O17.
What is the molecular weight of Megalomycin C1?
The molecular weight of Megalomycin C1 is 960.58 g/mol.
Where can I buy Megalomycin C1?
You can request a quote for Megalomycin C1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Megalomycin C1?
Yes, KEHONG BIO provides custom synthesis services for Megalomycin C1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.