NODULARIN

Base Information

• Chemical Name: NODULARIN
• CAS No.: 118399-22-7
• Molecular Formula: C41H60 N8 O10
• Molecular Weight: 824.96
• Mol file: 118399-22-7.mol

Synonyms:Cyclo[(Z)-2,3-didehydro-N-methyl-2-aminobutanoyl-erythro-3-methyl-D-b-aspartyl-L-arginyl-(2S,3S,4E,6E,8S,9S)-4,5,6,7-tetradehydro-9-methoxy-2,6,8-trimethyl-10-phenyl-3-aminodecanoyl-D-g-glutamyl];1,4,8,11,15-Pentaazacyclononadecane, cyclic peptide deriv.; Nodularin;Nodularin R

Chemical Property of NODULARIN

Chemical Property:

• Boiling Point: °Cat760mmHg
• PKA: 3.39±0.70(Predicted)
• Flash Point: °C
• PSA: 282.44000
• Density: 1.29g/cm³
• LogP: 3.62660
• Storage Temp.: −20°C
• Solubility.: methanol: 2 mg/mL Further dilute to 10% (v/v) methanol. Sto

Purity/Quality:

99% ^*data from raw suppliers

Nodularin ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T,F,T+
• Statements: 23/24/25-38-39/23/24/25-11-43-36/37/38-26/27/28
• Safety Statements: 36/37-45-16-7-36/37/39-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Description: The cyanobacterium Nodularia spumigena often contaminates the drinking water of rural communities in developing countries and accumulates in mussels, flounder, and cod from the northern Baltic Sea. Nodularin is a hepatotoxic monocylic pentapeptide produced by the N. spumigena. It is a potent inhibitor of protein phosphatase types 1 (PP1) and 2A (PP2A), exhibiting IC50 values of 1.8 and 0.026 nM, respectively. PP2B is inhibited to a lesser extent with an IC50 of 1.8 μM. No apparent inhibitory effect is observed with PP2C, alkaline phosphatase, acid phosphatase, insulin receptor tyrosine kinase, protein kinase A, phosphorylase kinase, or protein kinase C.
• Uses: Nodularin-R is a cyclic peptide toxin produced by freshwater cyanobacteria.

Technology Process of NODULARIN

There total 2 articles about NODULARIN 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:

Nod-AM2 (1187315-06-5) → nodularin (118399-22-7)

Guidance literature:

With pig liver esterase; Enzymatic reaction;

DOI:10.1021/jm900502e

Reference yield:

Nod-PM2 (1187315-08-7) → nodularin (118399-22-7)

Guidance literature:

With pig liver esterase; Enzymatic reaction;

DOI:10.1021/jm900502e

Reference yield:

acetoxymethyl bromide (590-97-6) + nodularin (118399-22-7) → Nod-AM2 (1187315-06-5)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dimethyl sulfoxide; at 20 ℃; Inert atmosphere;

DOI:10.1021/jm900502e

upstream raw materials:

Nod-AM₂

Nod-PM₂

Downstream raw materials:

Nod-AM₂

Nod-PM₂

Refernces