Tunicamycin A1 homolog
TL;DR: Tunicamycin A1 homolog (CAS 66081-37-6) is a chemical compound with molecular formula C37H60N4O16 and molecular weight 816.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[2-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl]-4,5-dihydroxyoxan-3-yl]-12-methyltridec-2-enamide
Also Known As: tunicamycin C, Tunicamycin A1, Tunicamyin C putative, TUNICAMYCIN A1 HOMOLOG, (E)-N-[2-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl]-4,5-dihydroxyoxan-3-yl]-12-methyltridec-2-enamide
| Molecular Formula | C37H60N4O16 |
|---|---|
| Molecular Weight | 816.40 g/mol |
| LogP | -2.8684 |
| Topological Polar Surface Area | 311.82 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 19 |
| Exact Mass | 816.40045 |
| Heavy Atoms | 57 |
| Complexity | 1574.1023 |
Chemical Identifiers
| CAS Number | 66081-37-6 |
|---|---|
| SMILES | CC(C)CCCCCCCC/C=C/C(=O)NC1C(C(C(OC1OC2C(C(C(C(O2)CO)O)O)NC(=O)C)CC(C3C(C(C(O3)N4C=CC(=O)NC4=O)O)O)O)O)O |
Product Overview
Tunicamycin A1 homolog (CAS 66081-37-6), with molecular formula C37H60N4O16 and molecular weight 816.40 g/mol. IUPAC: (E)-N-[2-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl]-4,5-dihydroxyoxan-3-yl]-12-methyltridec-2-enamide.
Chemical Property Profile of Tunicamycin A1 homolog
Property Insights of Tunicamycin A1 homolog
The XLogP value of -2.8684 indicates that Tunicamycin A1 homolog is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 311.82 Ų indicates high polarity, suggesting Tunicamycin A1 homolog may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tunicamycin A1 homolog has 11 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tunicamycin A1 homolog?
The CAS number of Tunicamycin A1 homolog is 66081-37-6.
What is the molecular formula of Tunicamycin A1 homolog?
The molecular formula of Tunicamycin A1 homolog is C37H60N4O16.
What is the molecular weight of Tunicamycin A1 homolog?
The molecular weight of Tunicamycin A1 homolog is 816.40 g/mol.
Where can I buy Tunicamycin A1 homolog?
You can request a quote for Tunicamycin A1 homolog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tunicamycin A1 homolog?
Yes, KEHONG BIO provides custom synthesis services for Tunicamycin A1 homolog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.