Tuftsinyltuftsin
TL;DR: Tuftsinyltuftsin (CAS 85409-44-5) is a chemical compound with molecular formula C42H78N16O11 and molecular weight 982.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Tuftsinyltuftsin, Thr-lys-pro-arg-thr-lys-pro-arg, Threonyl-lysyl-prolyl-arginyl-threonyl-lysyl-prolyl-arginine, L-Arginine, N2-(1-(N2-(N-(N2-(1-(N2-L-threonyl-L-lysyl)-L-prolyl)-L-arginyl)-L-threonyl)-L-lysyl)-L-prolyl)-, (2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
| Molecular Formula | C42H78N16O11 |
|---|---|
| Molecular Weight | 982.60 g/mol |
| LogP | -8.3 |
| Topological Polar Surface Area | 471.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 31 |
| Exact Mass | 982.6036 |
| Heavy Atoms | 69 |
| Complexity | 1780.0 |
Chemical Identifiers
| CAS Number | 85409-44-5 |
|---|---|
| SMILES | C[C@H]([C@@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)N)O |
| InChIKey | GCQKMLBIJULQQS-YCSONJRRSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tuftsinyltuftsin (CAS 85409-44-5), with molecular formula C42H78N16O11 and molecular weight 982.60 g/mol. IUPAC: (2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid.
Chemical Property Profile of Tuftsinyltuftsin
Property Insights of Tuftsinyltuftsin
The XLogP value of -8.3 indicates that Tuftsinyltuftsin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 471.0 Ų indicates high polarity, suggesting Tuftsinyltuftsin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tuftsinyltuftsin has 15 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tuftsinyltuftsin?
The CAS number of Tuftsinyltuftsin is 85409-44-5.
What is the molecular formula of Tuftsinyltuftsin?
The molecular formula of Tuftsinyltuftsin is C42H78N16O11.
What is the molecular weight of Tuftsinyltuftsin?
The molecular weight of Tuftsinyltuftsin is 982.60 g/mol.
Where can I buy Tuftsinyltuftsin?
You can request a quote for Tuftsinyltuftsin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tuftsinyltuftsin?
Yes, KEHONG BIO provides custom synthesis services for Tuftsinyltuftsin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.