Janolusimide

Base Information

• Chemical Name: Janolusimide
• CAS No.: 103612-45-9
• Molecular Formula: C19H33 N3 O5
• Molecular Weight: 383.4824
• DSSTox Substance ID: DTXSID20145947
• Nikkaji Number: J1.324.986E
• Wikidata: Q83010659
• Metabolomics Workbench ID: 178337
• Mol file: 103612-45-9.mol

Synonyms:Janolusimide;103612-45-9;(S)-N-((2S,3S,4R)-3-hydroxy-5-((S)-5-isopropyl-3,3-dimethyl-2,4-dioxopyrrolidin-1-yl)-4-methyl-5-oxopentan-2-yl)-2-(methylamino)propanamide;(2S)-N-[(2S,3S,4R)-5-[(5S)-3,3-dimethyl-2,4-dioxo-5-propan-2-ylpyrrolidin-1-yl]-3-hydroxy-4-methyl-5-oxopentan-2-yl]-2-(methylamino)propanamide;DTXSID20145947;AKOS040752153

Chemical Property of Janolusimide

Chemical Property:

• Vapor Pressure: 1.5E-16mmHg at 25°C
• Boiling Point: 593.3°Cat760mmHg
• Flash Point: 312.6°C
• PSA: 119.30000
• Density: 1.126g/cm³
• LogP: 1.25380
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 383.24202116
• Heavy Atom Count: 27
• Complexity: 617

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1C(=O)C(C(=O)N1C(=O)C(C)C(C(C)NC(=O)C(C)NC)O)(C)C
• Isomeric SMILES: C[C@H]([C@@H]([C@H](C)NC(=O)[C@H](C)NC)O)C(=O)N1[C@H](C(=O)C(C1=O)(C)C)C(C)C