pelargonoyl cyclic decapeptide polymyxin M(1)
TL;DR: pelargonoyl cyclic decapeptide polymyxin M(1) (CAS 77554-83-7) is a chemical compound with molecular formula C56H103Cl5N16O14 and molecular weight 1398.63 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[5,14,17,23,29-pentakis(2-aminoethyl)-20,26-bis(1-hydroxyethyl)-11-[(4-hydroxyphenyl)methyl]-8-(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30-decaoxo-1,4,7,10,13,16,19,22,25,28-decazacyclotriacont-2-yl]ethyl]nonanamide;pentahydrochloride
Also Known As: Pcd-P(M), Pelargonoyl cyclic decapeptide polymyxin M(1), N-[2-[5,14,17,23,29-pentakis(2-aminoethyl)-20,26-bis(1-hydroxyethyl)-11-[(4-hydroxyphenyl)methyl]-8-(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30-decaoxo-1,4,7,10,13,16,19,22,25,28-decazacyclotriacont-2-yl]ethyl]nonanamide;pentahydrochloride, N-[2-[5,14,17,23,29-pentakis(2-aminoethyl)-20,26-bis(1-hydroxyethyl)-11-[(4-hydroxyphenyl)methyl]-8-(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30-decaoxo-1,4,7,10,13,16,19,22,25,28-decazacyclotriacont-2-yl]ethyl]nonanamide pentahydrochloride, Cyclic(L-alpha,gamma-diaminobutyryl-ngamma-(1-oxononyl)-L-alpha,gamma-diaminobutyryl-L-alpha,gamma-diaminobutyryl-D-leucyl-L-threonyl-L-alpha,gamma-diaminobutyryl-L-alpha,gamma-diaminobutyryl-L-threonyl-L-alpha,gamma-diaminobutyryl-L-threonyl), pentahydrochloride
| Molecular Formula | C56H103Cl5N16O14 |
|---|---|
| Molecular Weight | 1398.63 g/mol |
| LogP | -3.2861 |
| Topological Polar Surface Area | 511.0 Ų |
| Hydrogen Bond Donors | 24 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 26 |
| Exact Mass | 1398.6282 |
| Heavy Atoms | 91 |
| Complexity | 2170.0 |
Chemical Identifiers
| CAS Number | 77554-83-7 |
|---|---|
| SMILES | CCCCCCCCC(=O)NCCC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCN)C(C)O)CCN)C(C)O)CCN)CCN)CC2=CC=C(C=C2)O)CC(C)C)CCN.Cl.Cl.Cl.Cl.Cl |
| InChIKey | JGDVPHMBJZOZLP-UHFFFAOYSA-N |
Product Overview
pelargonoyl cyclic decapeptide polymyxin M(1) (CAS 77554-83-7), with molecular formula C56H103Cl5N16O14 and molecular weight 1398.63 g/mol. IUPAC: N-[2-[5,14,17,23,29-pentakis(2-aminoethyl)-20,26-bis(1-hydroxyethyl)-11-[(4-hydroxyphenyl)methyl]-8-(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30-decaoxo-1,4,7,10,13,16,19,22,25,28-decazacyclotriacont-2-yl]ethyl]nonanamide;pentahydrochloride.
Chemical Property Profile of pelargonoyl cyclic decapeptide polymyxin M(1)
Property Insights of pelargonoyl cyclic decapeptide polymyxin M(1)
The XLogP value of -3.2861 indicates that pelargonoyl cyclic decapeptide polymyxin M(1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 511.0 Ų indicates high polarity, suggesting pelargonoyl cyclic decapeptide polymyxin M(1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, pelargonoyl cyclic decapeptide polymyxin M(1) has 24 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 pelargonoyl cyclic decapeptide polymyxin M(1)?
The CAS number of pelargonoyl cyclic decapeptide polymyxin M(1) is 77554-83-7.
What is the molecular formula of pelargonoyl cyclic decapeptide polymyxin M(1)?
The molecular formula of pelargonoyl cyclic decapeptide polymyxin M(1) is C56H103Cl5N16O14.
What is the molecular weight of pelargonoyl cyclic decapeptide polymyxin M(1)?
The molecular weight of pelargonoyl cyclic decapeptide polymyxin M(1) is 1398.63 g/mol.
Where can I buy pelargonoyl cyclic decapeptide polymyxin M(1)?
You can request a quote for pelargonoyl cyclic decapeptide polymyxin M(1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for pelargonoyl cyclic decapeptide polymyxin M(1)?
Yes, KEHONG BIO provides custom synthesis services for pelargonoyl cyclic decapeptide polymyxin M(1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.