Purpureacin 2

Base Information

• Chemical Name: Purpureacin 2
• CAS No.: 149990-60-3
• Molecular Formula: C37H66 O8
• DSSTox Substance ID: DTXSID701107539
• Nikkaji Number: J2.429.259B
• Wikidata: Q104976307
• Mol file: 149990-60-3.mol

Synonyms:149990-60-3;Purpureacin 2;Purpreacin 2;12-Hydroxybullatacin;DTXSID701107539;2(5H)-Furanone, 5-methyl-3-[2,10,13-trihydroxy-13-[octahydro-5'-(1-hydroxyundecyl)[2,2'-bifuran]-5-yl]tridecyl]-

Chemical Property of Purpureacin 2

Chemical Property:

• XLogP3: 8.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 25
• Exact Mass: 638.47576906
• Heavy Atom Count: 45
• Complexity: 833

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(CCC(CCCCCCCC(CC3=CC(OC3=O)C)O)O)O)O