Cefoselisum

Base Information

• Chemical Name: Cefoselisum
• CAS No.: 122841-10-5
• Molecular Formula: C₁₉H₂₂N₈O₆S₂
• Molecular Weight: 522.566
• Wikidata: Q76512360
• Metabolomics Workbench ID: 70776
• ChEMBL ID: CHEMBL4303186
• Mol file: 122841-10-5.mol

Synonyms:cefoselisum;CFSL;Cefoselis sulfate;C11210;D07646;(6R,7R)-7-[[(2Z)-2-(2-AMINO-1,3-THIAZOL-4-YL)-2-METHOXYIMINOACETYL]AMINO]-3-[[2-(2-HYDROXYETHYL)-3-IMINOPYRAZOL-1-YL]METHYL]-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID;5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[2,3-dihydro-2-(2-hydroxyethyl)-3-imino-1H-pyrazol-1-yl]methyl]-8-oxo-, (6R,7R)-;CHEBI:3496;SCHEMBL3075032;CHEMBL4303186;HY-B0186;CS-2073;NCGC00379079-03;BRD-K72339976-065-02-1;BRD-K72339976-065-03-9;BRD-K72339976-065-04-7;(6R,7R)-7-[[(2Z)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-3-[[2-(2-hydroxyethyl)-3-imino-pyrazol-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;(6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-{[2-(2-hydroxyethyl)-3-imino-2,3-dihydro-1H-pyrazol-1-yl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-{[2-(2-hydroxyethyl)-3-imino-2,3-dihydro-1H-pyrazol-1-yl]methyl}-3,4-didehydrocepham-4-carboxylic acid

Chemical Property of Cefoselisum

Chemical Property:

• PKA: 2.77±0.50(Predicted)
• PSA: 341.62000
• Density: 1.83±0.1 g/cm3(Predicted)
• LogP: -0.24530
• Solubility.: Soluble in DMSO
• XLogP3: -2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 9
• Exact Mass: 522.11037280
• Heavy Atom Count: 35
• Complexity: 1020

Purity/Quality:

99% ^*data from raw suppliers

Cefoselis 98+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)CN4C=CC(=N)N4CCO)C(=O)O
• Isomeric SMILES: CO/N=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CN4C=CC(=N)N4CCO)C(=O)O

Technology Process of Cefoselisum

There total 1 articles about Cefoselisum 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:

→ cefoselis (122841-10-5)

Guidance literature:

Refernces