Amycin A
TL;DR: Amycin A (CAS 116296-63-0) is a chemical compound with molecular formula C62H105N3O21 and molecular weight 1227.72 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-11-(3,5,9,11,13,17,27,29,31,40-decahydroxy-6,10,14,18,22,28-hexamethyl-19,35,37-trioxo-2,20,34,38-tetraoxatricyclo[31.8.1.03,39]dotetraconta-15,23,25-trien-21-yl)-9-methyldodec-4-enyl]-2-methylguanidine;propanedioic acid
Also Known As: Amycin A, Scopafungin, mono(hydrogen propanedioate), 1-[(E)-11-(3,5,9,11,13,17,27,29,31,40-decahydroxy-6,10,14,18,22,28-hexamethyl-19,35,37-trioxo-2,20,34,38-tetraoxatricyclo[31.8.1.03,39]dotetraconta-15,23,25-trien-21-yl)-9-methyldodec-4-enyl]-2-methylguanidine;propanedioic acid, 1-[(E)-11-[(15Z,23Z,25Z)-3,5,9,11,13,17,27,29,31,40-decahydroxy-6,10,14,18,22,28-hexamethyl-19,35,37-trioxo-2,20,34,38-tetraoxatricyclo[31.8.1.03,39]dotetraconta-15,23,25-trien-21-yl]-9-methyldodec-4-enyl]-2-methylguanidine;propanedioic acid
| Molecular Formula | C62H105N3O21 |
|---|---|
| Molecular Weight | 1227.72 g/mol |
| LogP | 3.3294 |
| Topological Polar Surface Area | 415.44 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 13 |
| Exact Mass | 1227.724 |
| Heavy Atoms | 86 |
| Complexity | 2183.8174 |
Chemical Identifiers
| CAS Number | 116296-63-0 |
|---|---|
| SMILES | CC1CCC(C(C(CC(C(C=CC(C(C(=O)OC(C(C=CC=CC(C(C(CC(CC2CC3CC(C(C(O3)(CC1O)O)OC(=O)CC(=O)O2)O)O)O)C)O)C)C(C)CC(C)CCC/C=C/CCCNC(=NC)N)C)O)C)O)O)C)O.C(C(=O)O)C(=O)O |
Product Overview
Amycin A (CAS 116296-63-0), with molecular formula C62H105N3O21 and molecular weight 1227.72 g/mol. IUPAC: 1-[(E)-11-(3,5,9,11,13,17,27,29,31,40-decahydroxy-6,10,14,18,22,28-hexamethyl-19,35,37-trioxo-2,20,34,38-tetraoxatricyclo[31.8.1.03,39]dotetraconta-15,23,25-trien-21-yl)-9-methyldodec-4-enyl]-2-methylguanidine;propanedioic acid.
Chemical Property Profile of Amycin A
Property Insights of Amycin A
The XLogP value of 3.3294 indicates that Amycin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 415.44 Ų indicates high polarity, suggesting Amycin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Amycin A has 14 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amycin A?
The CAS number of Amycin A is 116296-63-0.
What is the molecular formula of Amycin A?
The molecular formula of Amycin A is C62H105N3O21.
What is the molecular weight of Amycin A?
The molecular weight of Amycin A is 1227.72 g/mol.
Where can I buy Amycin A?
You can request a quote for Amycin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amycin A?
Yes, KEHONG BIO provides custom synthesis services for Amycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.