Yinyanghuo A

Base Information

• Chemical Name: Yinyanghuo A
• CAS No.: 174391-72-1
• Molecular Formula: C25H24 O6
• Molecular Weight: 420.45
• Nikkaji Number: J869.454K
• Wikidata: Q27135095
• Metabolomics Workbench ID: 23513
• ChEMBL ID: CHEMBL462969
• Mol file: 174391-72-1.mol

Synonyms:Yinyanghuo A;174391-72-1;CHEBI:66492;5,7-dihydroxy-2-[8-(2-hydroxy-3-methylbut-3-enyl)-2,2-dimethylchromen-6-yl]chromen-4-one;4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(8-(2-hydroxy-3-methyl-3-butenyl)-2,2-dimethyl-2H-1-benzopyran-6-yl)-, (-)-;CHEMBL462969;SCHEMBL3679541;LMPK12110428;Q27135095;5,7-dihydroxy-8'-(2-hydroxy-3-methylbut-3-en-1-yl)-2',2'-dimethyl-2'H,4H-2,6'-bichromen-4-one

Chemical Property of Yinyanghuo A

Chemical Property:

• Melting Point: 230-232 °C
• Boiling Point: 656.1±55.0 °C(Predicted)
• Density: 1.310±0.06 g/cm3(Predicted)
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 420.15728848
• Heavy Atom Count: 31
• Complexity: 783

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=C)C(CC1=CC(=CC2=C1OC(C=C2)(C)C)C3=CC(=O)C4=C(C=C(C=C4O3)O)O)O