Malyl-coenzyme A

Base Information

• Chemical Name: Malyl-coenzyme A
• CAS No.: 2043-93-8
• Molecular Formula: C25H40 N7 O20 P3 S
• Molecular Weight: 883.61
• DSSTox Substance ID: DTXSID50862817
• Mol file: 2043-93-8.mol

Synonyms:coenzyme A, malyl-;malyl-CoA;malyl-coenzyme A

Chemical Property of Malyl-coenzyme A

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 482.87000
• Density: 1.96g/cm³
• LogP: -0.23790
• XLogP3: -6.8
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 25
• Rotatable Bond Count: 23
• Exact Mass: 883.12616886
• Heavy Atom Count: 56
• Complexity: 1550

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(C(=O)O)O)O