Annonin

Base Information

• Chemical Name: Annonin
• CAS No.: 102713-74-6
• Molecular Formula: C37H66 O7
• Molecular Weight: 622.9157
• DSSTox Substance ID: DTXSID60908013

Synonyms:Annonin;102713-74-6;DTXSID60908013;3-{2,13-Dihydroxy-13-[5'-(1-hydroxyundecyl)[2,2'-bioxolan]-5-yl]tridecyl}-5-methylfuran-2(5H)-one

Chemical Property of Annonin

Chemical Property:

• Vapor Pressure: 1.19E-25mmHg at 25°C
• Boiling Point: 745.5°C at 760 mmHg
• Flash Point: 220.3°C
• Density: 1.054g/cm³
• XLogP3: 9.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 25
• Exact Mass: 622.48085444
• Heavy Atom Count: 44
• Complexity: 801

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(CCCCCCCCCCC(CC3=CC(OC3=O)C)O)O)O
• Isomeric SMILES: CCCCCCCCCC[C@@H]([C@H]1CCC(O1)[C@H]2CC[C@@H](O2)[C@@H](CCCCCCCCCCC(CC3=C[C@@H](OC3=O)C)O)O)O

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