Ohioensin-A

Base Information

• Chemical Name: Ohioensin-A
• CAS No.: 121353-47-7
• Molecular Formula: C23H16O5
• Molecular Weight: 372.3701
• DSSTox Substance ID: DTXSID80331864
• Nikkaji Number: J2.752.873B
• Wikidata: Q27107572
• ChEMBL ID: CHEMBL403093

Synonyms:Ohioensin A;Ohioensin-A;CHEBI:7732;121353-47-7;(1R,15S,23S)-4,9,11-trihydroxy-22-oxahexacyclo[10.10.2.02,7.08,24.015,23.016,21]tetracosa-2(7),3,5,8(24),9,11,16,18,20-nonaen-13-one;C09956;CHEMBL403093;DTXSID80331864;BDBM50374279;Q27107572

Chemical Property of Ohioensin-A

Chemical Property:

• Vapor Pressure: 1.77E-16mmHg at 25°C
• Boiling Point: 630.2°C at 760 mmHg
• Flash Point: 228.9°C
• Density: 1.522g/cm³
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 372.09977361
• Heavy Atom Count: 28
• Complexity: 651

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2C3C(C4=C(C=CC(=C4)O)C5=C3C(=C(C=C5O)O)C1=O)OC6=CC=CC=C26
• Isomeric SMILES: C1[C@H]2[C@@H]3[C@H](C4=C(C=CC(=C4)O)C5=C3C(=C(C=C5O)O)C1=O)OC6=CC=CC=C26

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