Mureidomycin E
TL;DR: Mureidomycin E (CAS 126049-02-3) is a chemical compound with molecular formula C39H48N8O12S and molecular weight 852.3112 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[(2S)-1-[[2-amino-3-[(8-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-methylamino]butanoyl]-[(E)-[5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-ylidene]methyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid
Also Known As: Mureidomycin E, 2-[[(2S)-1-[[2-amino-3-[(8-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-methylamino]butanoyl]-[(E)-[5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-ylidene]methyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid, Butanamide, N-(((1-carboxy-2-(3-hydroxyphenyl)ethyl)amino)carbonyl)methionyl-N-((5-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)dihydro-4-hydroxy-2(3H)-furanylidene)methyl)-N3-methyl-N3-((1,2,3,4-tetrahydro-8-hydroxy-3-isoquinolinyl)carbonyl)-D-2,3-diamino-
Technical Specifications
| Molecular Formula | C39H48N8O12S |
| Molecular Weight | 852.3112 g/mol |
| XLogP | -2.8 |
| Topological Polar Surface Area (TPSA) | 319.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 15 |
| Exact Mass | 852.3112 Da |
| Heavy Atoms | 60 |
| Complexity | 1680.0 |
| SMILES | CC(C(C(=O)N(/C=C/1\CC(C(O1)N2C=CC(=O)NC2=O)O)C(=O)[C@H](CCSC)NC(=O)NC(CC3=CC(=CC=C3)O)C(=O)O)N)N(C)C(=O)C4CC5=C(CN4)C(=CC=C5)O |
| InChIKey | ZZUYKUQLXZOTKJ-HZDUZTPTSA-N |
Chemical Property Profile of Mureidomycin E
Property Insights of Mureidomycin E
The XLogP value of -2.8 indicates that Mureidomycin E is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 319.0 Ų indicates high polarity, suggesting Mureidomycin E may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mureidomycin E has 9 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Mureidomycin E?
The CAS number of Mureidomycin E is 126049-02-3.
What is the molecular formula of Mureidomycin E?
The molecular formula of Mureidomycin E is C39H48N8O12S.
What is the molecular weight of Mureidomycin E?
The molecular weight of Mureidomycin E is 852.3112 g/mol.
Where can I buy Mureidomycin E?
You can request a quote for Mureidomycin E directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mureidomycin E?
Yes, CoreyChem provides custom synthesis services for Mureidomycin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.