Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine
TL;DR: Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine (CAS 145079-47-6) is a chemical compound with molecular formula C22H35N5O15P2 and molecular weight 671.16046 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,5S)-5-amino-2-[(2S,3R)-2-amino-3-hydroxybutanoyl]-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]-phosphonoamino]-4-oxo-3-phosphonohexanoic acid
Also Known As: Atptpsa, Ala-thr(P)-tyr(P)-ser-ala, Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine, (2R,5S)-5-amino-2-[(2S,3R)-2-amino-3-hydroxybutanoyl]-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]-phosphonoamino]-4-oxo-3-phosphonohexanoic acid, 4-Amino-2-[{N-[(2S)-2-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]-L-seryl}(phosphono)amino]-2-[(3S)-3-amino-2-oxo-1-phosphonobutyl]-2,4,6-trideoxy-D-xylo-hex-3-ulosonic acid
Technical Specifications
| Molecular Formula | C22H35N5O15P2 |
| Molecular Weight | 671.16046 g/mol |
| XLogP | -13.6 |
| Topological Polar Surface Area (TPSA) | 375.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 16 |
| Exact Mass | 671.16046 Da |
| Heavy Atoms | 44 |
| Complexity | 1190.0 |
| SMILES | C[C@H]([C@@H](C(=O)[C@](C(C(=O)[C@H](C)N)P(=O)(O)O)(C(=O)O)N(C(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=C(C=C1)O)N)P(=O)(O)O)N)O |
| InChIKey | GCSAMAGHTYPNJU-CVQONXBLSA-N |
Chemical Property Profile of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine
Property Insights of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine
The XLogP value of -13.6 indicates that Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 375.0 Ų indicates high polarity, suggesting Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine has 12 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine?
The CAS number of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine is 145079-47-6.
What is the molecular formula of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine?
The molecular formula of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine is C22H35N5O15P2.
What is the molecular weight of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine?
The molecular weight of Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine is 671.16046 g/mol.
Where can I buy Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine?
You can request a quote for Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine?
Yes, CoreyChem provides custom synthesis services for Alanyl-phosphothreonyl-phosphotyrosyl-seryl-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.