Amphotericin B 2-morpholinoethyl amide diaspartate
TL;DR: Amphotericin B 2-morpholinoethyl amide diaspartate (CAS 130176-10-2) is a chemical compound with molecular formula C61H99N5O25 and molecular weight 1301.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((2S)-2-aminobutanedioic acid);(19E,21E,23E,25E,27E,29E,31E)-33-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-N-(2-morpholin-4-ylethyl)-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide
Also Known As: AB-2-Meada, Amphotericin B 2-morpholinoethyl amide diaspartate, (2S)-2-aminobutanedioic acid;(19E,21E,23E,25E,27E,29E,31E)-33-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-N-(2-morpholin-4-ylethyl)-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide, Amphotericin B, 16-decarboxy-16-(((2-(4-morpholinyl)ethyl)amino)carbonyl)-, L-aspartate (1:2) (salt), L-Aspartic acid, compd. with 16-decarboxy-16-(((2-(4-morpholinyl)ethyl)amino)carbonyl)amphotericin B (2:1)
| Molecular Formula | C61H99N5O25 |
|---|---|
| Molecular Weight | 1301.66 g/mol |
| LogP | -2.1785 |
| Topological Polar Surface Area | 525.12 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 12 |
| Exact Mass | 1301.663 |
| Heavy Atoms | 91 |
| Complexity | 2390.8396 |
Chemical Identifiers
| CAS Number | 130176-10-2 |
|---|---|
| SMILES | CC1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C(CC2C(C(CC(O2)(CC(CC(C(CCC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)NCCN3CCOCC3)OC4C(C(C(C(O4)C)O)N)O.C([C@@H](C(=O)O)N)C(=O)O.C([C@@H](C(=O)O)N)C(=O)O |
Product Overview
Amphotericin B 2-morpholinoethyl amide diaspartate (CAS 130176-10-2), with molecular formula C61H99N5O25 and molecular weight 1301.66 g/mol. IUPAC: bis((2S)-2-aminobutanedioic acid);(19E,21E,23E,25E,27E,29E,31E)-33-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-N-(2-morpholin-4-ylethyl)-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide.
Chemical Property Profile of Amphotericin B 2-morpholinoethyl amide diaspartate
Property Insights of Amphotericin B 2-morpholinoethyl amide diaspartate
The XLogP value of -2.1785 indicates that Amphotericin B 2-morpholinoethyl amide diaspartate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 525.12 Ų indicates high polarity, suggesting Amphotericin B 2-morpholinoethyl amide diaspartate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Amphotericin B 2-morpholinoethyl amide diaspartate has 18 hydrogen bond donor(s) and 25 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amphotericin B 2-morpholinoethyl amide diaspartate?
The CAS number of Amphotericin B 2-morpholinoethyl amide diaspartate is 130176-10-2.
What is the molecular formula of Amphotericin B 2-morpholinoethyl amide diaspartate?
The molecular formula of Amphotericin B 2-morpholinoethyl amide diaspartate is C61H99N5O25.
What is the molecular weight of Amphotericin B 2-morpholinoethyl amide diaspartate?
The molecular weight of Amphotericin B 2-morpholinoethyl amide diaspartate is 1301.66 g/mol.
Where can I buy Amphotericin B 2-morpholinoethyl amide diaspartate?
You can request a quote for Amphotericin B 2-morpholinoethyl amide diaspartate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amphotericin B 2-morpholinoethyl amide diaspartate?
Yes, KEHONG BIO provides custom synthesis services for Amphotericin B 2-morpholinoethyl amide diaspartate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.