Heteroartonin A

Base Information

• Chemical Name: Heteroartonin A
• CAS No.: 170894-23-2
• Molecular Formula: C26H28 O7
• Molecular Weight: 452.5
• DSSTox Substance ID: DTXSID401104798
• Metabolomics Workbench ID: 23992
• Nikkaji Number: J690.534J
• Wikidata: Q105194578
• Mol file: 170894-23-2.mol

Synonyms:Heteroartonin A;CHEBI:169804;DTXSID401104798;LMPK12110909;170894-23-2;2',5,5',7-tetrahydroxy-4'-methoxy-3,3' -diprenylflavone;2',5,5',7-Tetrahydroxy-4'-methoxy-3,3'-diprenylflavone;2-[2,5-Dihydroxy-4-methoxy-3-(3-methyl-2-buten-1-yl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one;2-[2,5-Dihydroxy-4-methoxy-3-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one;2-[2,5-dihydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-3-(3-methylbut-2-enyl)chromen-4-one

Chemical Property of Heteroartonin A

Chemical Property:

• PSA: 120.36000
• LogP: 5.30840
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 452.18350323
• Heavy Atom Count: 33
• Complexity: 806

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MSDS Files:

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• Canonical SMILES: CC(=CCC1=C(C(=CC(=C1OC)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)CC=C(C)C)O)C

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