PM-Toxin A

Base Information

• Chemical Name: PM-Toxin A
• CAS No.: 88212-12-8
• Molecular Formula: C33H60O8
• Molecular Weight: 584.8247
• DSSTox Substance ID: DTXSID70236899
• Nikkaji Number: J133.875G
• Wikidata: Q27107603
• Metabolomics Workbench ID: 68238
• Mol file: 88212-12-8.mol

Synonyms:PM-Toxin A;AC1L4LG3;88212-12-8;C08553;(4R,12R,20R,28R)-4,12,20,28-tetrahydroxytritriacontane-2,10,18,26-tetrone;2,10,18,26-Tritriacontanetetrone, 4,12,20,28-tetrahydroxy-, (4R,12R,20R,28R)-;PM toxin A;CHEBI:7879;DTXSID70236899;LMFA05000693;Q27107603;(4R,12R,20R,28R)-4,12,20,28-Tetrahydroxy-2,10,18,26-tritriacontanetetrone

Chemical Property of PM-Toxin A

Chemical Property:

• Vapor Pressure: 1.77E-26mmHg at 25°C
• Boiling Point: 757.4°Cat760mmHg
• Flash Point: 425.8°C
• PSA: 149.20000
• Density: 1.057g/cm³
• LogP: 5.71850
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 30
• Exact Mass: 584.42881887
• Heavy Atom Count: 41
• Complexity: 707

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(CC(=O)CCCCCC(CC(=O)CCCCCC(CC(=O)CCCCCC(CC(=O)C)O)O)O)O
• Isomeric SMILES: CCCCC[C@H](CC(=O)CCCCC[C@H](CC(=O)CCCCC[C@H](CC(=O)CCCCC[C@H](CC(=O)C)O)O)O)O