Nonathymulin

Base Information

• Chemical Name: Nonathymulin
• CAS No.: 63958-90-7
• Deprecated CAS: 67809-77-2,69989-83-9
• Molecular Formula: C33H54N12O15
• Molecular Weight: 858.863
• UNII: 9H198D04WL
• DSSTox Substance ID: DTXSID10213801
• Nikkaji Number: J33.121J
• Wikipedia: Thymulin
• Wikidata: Q2007601
• NCI Thesaurus Code: C174576
• ChEMBL ID: CHEMBL2106455
• Mol file: 63958-90-7.mol

Synonyms:Circulating Factor, Thymic;Circulating Thymic Factor;Facteur Thymique Serique;Factor, Circulating Thymic;Factor, Serum Thymic;Factor, Thymic Circulating;Factor, Thymic Serum;Nonathymulin;Serique, Facteur Thymique;Serum Factor, Thymic;Serum Thymic Factor;Thymic Circulating Factor;Thymic Factor, Circulating;Thymic Factor, Serum;Thymic Serum Factor;Thymique Serique, Facteur;Thymulin;Thymuline

Chemical Property of Nonathymulin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.575
• Boiling Point: 1658.9 °C at 760 mmHg
• PKA: 3.08±0.10(Predicted)
• Flash Point: 957.1 °C
• PSA: 451.86000
• Density: 1.417 g/cm³
• LogP: -3.67790
• Storage Temp.: −20°C
• Solubility.: deionized water: soluble
• XLogP3: -10.9
• Hydrogen Bond Donor Count: 15
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 28
• Exact Mass: 858.38315906
• Heavy Atom Count: 60
• Complexity: 1610

Purity/Quality:

99% ^*data from raw suppliers

SERUM THYMIC FACTOR 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)NC(CCC(=O)N)C(=O)NCC(=O)NCC(=O)NC(CO)C(=O)NC(CC(=O)N)C(=O)O)NC(=O)C1CCC(=O)N1
• Isomeric SMILES: C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@@H]1CCC(=O)N1

Technology Process of Nonathymulin

There total 22 articles about Nonathymulin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 84.0%

pyroglutamyl-alanyl-Nε-benzyloxycarbonyllysyl-seryl-glutaminyl-glycyl-glycyl-seryl-asparagine 4-nitrobenzyl ester (110523-43-8) → pyroglutamyl-alanyl-lysyl-seryl-glutaminyl-glycyl-glycyl-seryl-asparagine (63958-90-7)

Guidance literature:

With hydrogen; palladium; In water; acetic acid; for 12h; Ambient temperature;

Reference yield: 52.0%

Z-Pyr-Ala-Lys(Z)-Ser-Asn-Gly-Gly-Ser-Gln-ONb → pyroglutamyl-alanyl-lysyl-seryl-glutaminyl-glycyl-glycyl-seryl-asparagine (63958-90-7)

Guidance literature:

With hydrogen; palladium on activated charcoal; In acetic acid; for 24h;

DOI:10.1248/cpb.30.4448

Reference yield:

tert.-butyloxycarbonylalanyl-Nε-benzyloxycarbonyllysyl-serine methyl ester (84983-67-5) → pyroglutamyl-alanyl-lysyl-seryl-glutaminyl-glycyl-glycyl-seryl-asparagine (63958-90-7)

Guidance literature:

Multi-step reaction with 4 steps

1: 1.) TFA, anisole 2.) NMM, HOBT, WSCl / 1.) room temperature, 20 min 2.) DMF, 0 deg C, overnight, 4 deg C

2: 94 percent / hydrazine hydrate / dimethylformamide; methanol / 48 h / Ambient temperature

4: 52 percent / H₂ / 10 percent Pd/C / aq. acetic acid / 24 h

With 4-methyl-morpholine; hydrogen; benzotriazol-1-ol; hydrazine hydrate; methoxybenzene; trifluoroacetic acid; palladium on activated charcoal; In methanol; acetic acid; N,N-dimethyl-formamide;

DOI:10.1248/cpb.30.4448

upstream raw materials:

pyroglutamyl-alanyl-N^ε-benzyloxycarbonyllysyl-seryl-glutaminyl-glycyl-glycyl-seryl-asparagine 4-nitrobenzyl ester

N^α-tert-butyloxycarbonyl-N^ε-benzyloxycarbonyllysine dicyclohexylammonium salt

tert.-butyloxycarbonylalanyl-N^ε-benzyloxycarbonyllysyl-serine methyl ester

Z-Pyr-Ala-Lys(Z)-Ser-OMe

Refernces

• 1、 Abiko,Sekino. "Effects of two synthetic serum thymic factor analogues and four thymic factor fragments on the low E-rosette forming cells in patients with chronic renal failure". . p. 4448 - 4456. Retrieved 2007/10/02.