Tuftsin - ≥95% , CAS No.9063-57-4

CAS: 9063-57-4 Cat. No.: T275465 Formula: C₂₁H₄₀N₈O₆ Molecular Weight: 500.6 PubChem CID: 156080

GRADE & PURITY ≥95%

Synonyms

DTXSID901336069 | L-Arginine, N2-(1-(N2-L-threonyl-L-lysyl)-L-prolyl)- | (2S)-2-[[(2S)-1-[(2S)-6-AMINO-2-[[(2S,3R)-2-AMINO-3-HYDROXY-BUTANOYL]AMINO]HEXANOYL]PYRROLIDINE-2-CARBONYL]AMINO]-5-(DIAMINOMETHYLIDENEAMINO)PENTANOIC ACID | (2S)-2-[[(2S)-1-[(2S)-6-

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Store at +4°C. The product can be stored for up to 12 months.

Specifications

Synonyms

DTXSID901336069 | L-Arginine, N2-(1-(N2-L-threonyl-L-lysyl)-L-prolyl)- | (2S)-2-[[(2S)-1-[(2S)-6-AMINO-2-[[(2S,3R)-2-AMINO-3-HYDROXY-BUTANOYL]AMINO]HEXANOYL]PYRROLIDINE-2-CARBONYL]AMINO]-5-(DIAMINOMETHYLIDENEAMINO)PENTANOIC ACID | (2S)-2-[[(2S)-1-[(2S)-6-

Specifications & Purity

≥95%

Biochemical and Physiological Mechanisms

Macrophage, microglial and polymorphonuclear leukocyte activator. Endogenous tetrapeptide. Immunogenic and antitumor agent. Active in vivo and in vitro .

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one week. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥95%

Names and Identifiers

• Canonical Smiles: CC(C(C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NC(CCCN=C(N)N)C(=O)O)N)O
• IUPAC Name: (2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
• InChIKey: IESDGNYHXIOKRW-YXMSTPNBSA-N
• INCHI: 1S/C21H40N8O6/c1-12(30)16(23)18(32)27-13(6-2-3-9-22)19(33)29-11-5-8-15(29)17(31)28-14(20(34)35)7-4-10-26-21(24)25/h12-16,30H,2-11,22-23H2,1H3,(H,27,32)(H,28,31)(H,34,35)(H4,24,25,26)/t12-,13+,14+,15+,16+/m1/s1
• Isomeric 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)O)N)O
• PubChem CID: 156080
• Molecular Weight: 500.6

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Oligopeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Oligopeptides
• Alternative Parents: Proline and derivatives N-acyl-L-alpha-amino acids Alpha amino acid amides Pyrrolidinecarboxamides N-acylpyrrolidines Hydroxy fatty acids Heterocyclic fatty acids N-acyl amines Tertiary carboxylic acid amides Secondary carboxylic acid amides Secondary alcohols Guanidines Amino acids Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Azacyclic compounds Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-oligopeptide - Proline or derivatives - N-acyl-l-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Alpha-amino acid amide - Alpha-amino acid or derivatives - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - N-acylpyrrolidine - Hydroxy fatty acid - Heterocyclic fatty acid - Fatty acyl - Fatty acid - N-acyl-amine - Fatty amide - Tertiary carboxylic acid amide - Pyrrolidine - Amino acid - Secondary carboxylic acid amide - Secondary alcohol - Guanidine - Carboxamide group - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Alcohol - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 500.600 g/mol
• XLogP3: -7.000
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 15
• Exact Mass: 500.307 Da
• Monoisotopic Mass: 500.307 Da
• Topological Polar Surface Area: 252.000 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 760.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 5
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1