Decoyinine

Base Information

• Chemical Name: Decoyinine
• CAS No.: 2004-04-8
• Deprecated CAS: 1373-27-9,21735-70-6
• Molecular Formula: C₁₁H₁₃N₅O₄
• Molecular Weight: 279.255
• European Community (EC) Number: 687-357-1
• DSSTox Substance ID: DTXSID50173859
• Nikkaji Number: J342.261E
• Wikipedia: Angustmycin_A
• Wikidata: Q72461692
• Metabolomics Workbench ID: 123495
• ChEMBL ID: CHEMBL1444741
• Mol file: 2004-04-8.mol

Synonyms:angustmycin A;decoyinin;decoyinine;U 7984;U-7984

Chemical Property of Decoyinine

Chemical Property:

• Vapor Pressure: 3.04E-17mmHg at 25°C
• Melting Point: 198-200℃
• Refractive Index: 1.822
• Boiling Point: 639.8°C at 760 mmHg
• PKA: 12.90±0.60(Predicted)
• Flash Point: 340.7°C
• PSA: 128.54000
• Density: 1.87g/cm³
• LogP: -0.98990
• XLogP3: -1.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 279.09675391
• Heavy Atom Count: 20
• Complexity: 410

Purity/Quality:

99%+, ^*data from raw suppliers

Decoyinine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=C1C(C(C(O1)(CO)N2C=NC3=C(N=CN=C32)N)O)O
• Isomeric SMILES: C=C1[C@H]([C@H]([C@](O1)(CO)N2C=NC3=C(N=CN=C32)N)O)O
• Uses: Decoyinin, is a Xanthosine monophosphate (XMP) aminase inhibitor and GMP synthetase inhibitor. It can also be used to study the inhibition of cell wall synthesis, to inhibit RNA synthesis, to lower intracellular GTP levels in Streptococcus mutans.

Technology Process of Decoyinine

There total 1 articles about Decoyinine 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:

→ decoyinine (2004-04-8,21735-70-6)

Guidance literature:

Streptomyces hygroscopicus var. decoyicus, NRRL 2666;