Megalomycin C2
TL;DR: Megalomycin C2 (CAS 49669-77-4) is a chemical compound with molecular formula C49H86N2O17 and molecular weight 974.59 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] propanoate
Also Known As: Megalomycin C2, Megalomicin C2, Antibiotic XK 41A1, XK-41-A1, W-847-C2
| Molecular Formula | C49H86N2O17 |
|---|---|
| Molecular Weight | 974.59 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 239.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 14 |
| Exact Mass | 974.59265 |
| Heavy Atoms | 68 |
| Complexity | 1700.0 |
Chemical Identifiers
| CAS Number | 49669-77-4 |
|---|---|
| SMILES | CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)OC(=O)CC)(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 | CZALPQDKXGHQPI-UHFFFAOYSA-N |
Product Overview
Megalomycin C2 (CAS 49669-77-4), with molecular formula C49H86N2O17 and molecular weight 974.59 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] propanoate.
Chemical Property Profile of Megalomycin C2
Property Insights of Megalomycin C2
The XLogP value of 4.3 indicates that Megalomycin C2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 239.0 Ų indicates high polarity, suggesting Megalomycin C2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Megalomycin C2 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 C2?
The CAS number of Megalomycin C2 is 49669-77-4.
What is the molecular formula of Megalomycin C2?
The molecular formula of Megalomycin C2 is C49H86N2O17.
What is the molecular weight of Megalomycin C2?
The molecular weight of Megalomycin C2 is 974.59 g/mol.
Where can I buy Megalomycin C2?
You can request a quote for Megalomycin C2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Megalomycin C2?
Yes, KEHONG BIO provides custom synthesis services for Megalomycin C2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.