Cholecystokinin 9
TL;DR: Cholecystokinin 9 (CAS 118074-08-1) is a chemical compound with molecular formula C55H74N14O17S3 and molecular weight 1298.4519 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-(4-sulfooxyphenyl)propan-2-yl]amino]-4-oxobutanoic acid
Also Known As: Cholecystokinin 9, CCK9 peptide, Caerulein, 1-de(5-oxo-L-proline)-2-L-arginine-5-L-methionine-, (3S)-3-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-(4-sulfooxyphenyl)propan-2-yl]amino]-4-oxobutanoic acid, (3S)-3-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-hydroxy-1,4-dioxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-(4-sulfooxyphenyl)propan-2-yl]amino]-4-oxobutanoic acid
Technical Specifications
| Molecular Formula | C55H74N14O17S3 |
| Molecular Weight | 1298.4519 g/mol |
| XLogP | -4.1 |
| Topological Polar Surface Area (TPSA) | 579.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 39 |
| Exact Mass | 1298.4519 Da |
| Heavy Atoms | 89 |
| Complexity | 2550.0 |
| SMILES | CSCC[C@@H](C(=O)NCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N)NC(=O)[C@H](CC4=CC=C(C=C4)OS(=O)(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCN=C(N)N)N |
| InChIKey | AOVFOMQIRNOPOR-LVHVEONVSA-N |
Chemical Property Profile of Cholecystokinin 9
Property Insights of Cholecystokinin 9
The XLogP value of -4.1 indicates that Cholecystokinin 9 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 579.0 Ų indicates high polarity, suggesting Cholecystokinin 9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cholecystokinin 9 has 16 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 Cholecystokinin 9?
The CAS number of Cholecystokinin 9 is 118074-08-1.
What is the molecular formula of Cholecystokinin 9?
The molecular formula of Cholecystokinin 9 is C55H74N14O17S3.
What is the molecular weight of Cholecystokinin 9?
The molecular weight of Cholecystokinin 9 is 1298.4519 g/mol.
Where can I buy Cholecystokinin 9?
You can request a quote for Cholecystokinin 9 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cholecystokinin 9?
Yes, CoreyChem provides custom synthesis services for Cholecystokinin 9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.