5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)
TL;DR: 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) (CAS 109214-84-8) is a chemical compound with molecular formula C15H26N7O14P3S and molecular weight 653.0471 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-4-[(2R)-2-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy-(phosphonoamino)phosphoryl]oxyphosphoryl]oxyethyl]sulfanylbutanoic acid
Also Known As: 5'-Hcmait, 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate), (2S)-2-amino-4-[(2R)-2-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy-(phosphonoamino)phosphoryl]oxyphosphoryl]oxyethyl]sulfanylbutanoic acid, 9H-Purin-6-amine, 9-[6-S-(3-amino-3-carboxypropyl)-5-O-[hydroxy[[hydroxy(phosphonoamino)phosphinyl]oxy]phosphinyl]-6-thio-, A-L-talofuranosyl]-, (S)- (9CI)
Technical Specifications
| Molecular Formula | C15H26N7O14P3S |
| Molecular Weight | 653.0471 g/mol |
| XLogP | -7.7 |
| Topological Polar Surface Area (TPSA) | 371.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 14 |
| Exact Mass | 653.0471 Da |
| Heavy Atoms | 40 |
| Complexity | 1040.0 |
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)[C@H](CSCC[C@@H](C(=O)O)N)OP(=O)(O)OP(=O)(NP(=O)(O)O)O)O)O)N |
| InChIKey | FBOLNTODBBAPDR-KEPZVFJZSA-N |
Chemical Property Profile of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)
Property Insights of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)
The XLogP value of -7.7 indicates that 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 371.0 Ų indicates high polarity, suggesting 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) has 10 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)?
The CAS number of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) is 109214-84-8.
What is the molecular formula of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)?
The molecular formula of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) is C15H26N7O14P3S.
What is the molecular weight of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)?
The molecular weight of 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) is 653.0471 g/mol.
Where can I buy 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)?
You can request a quote for 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate)?
Yes, CoreyChem provides custom synthesis services for 5'-((Homocysteinyl)methyl)adenosine 5'-(beta,gamma-imidotriphosphate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.