PDND
Phytochemical Database for Neurological Disorders
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Phytochemical Name : Bergamottin
PCNDIDB0050
Pubchem CID : 5471349
Molecular formula: C21H22O4

Molecular weight : 338.400

Canonical SMILES : CC(=CCCC(=CCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C)C

Synonymes : Bergamottin|7380-40-7|Bergaptin|Bergamotine|5-Geranoxypsoralen|Bergamotin|5-Geranyloxypsoralen|Bergomottin|UNII-JMU611YFRB|JMU611YFRB|4-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one|CCRIS 8085|CHEMBL1078442|CHEBI:70476|DTXSID50897528|MFCD00017409|7H-furo(3,2-g)(1)benzopyran-7-one, 4-(((2E)-3,7-dimethyl-2,6-octadien-1-yl)oxy)-|4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one|4-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-7H-furo[3,2-g][1]benzopyran-7-one|7H-Furo(3,2-g)(1)benzopyran-7-one, 4-((3,7-dimethyl-2,6-octadienyl)oxy)-, (E)-|Bergaptol geranyl ether|4-(((2E)-3,7-dimethylocta-2,6-dien-1-yl)oxy)-7H-furo(3,2-g)chromen-7-one|4-{[(2E)-3,7-Dimethylocta-2,6-dien-1-yl]oxy}-7H-furo[3,2-g]chromen-7-one|7H-Furo[3,2-g][1]benzopyran-7-one, 4-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-|BERGAMOTTIN [MI]|SCHEMBL569529|SCHEMBL7183139|Bergamottin, analytical standard|DTXCID601326883|HY-N2194|TNP00285|BDBM50310823|NSC710599|AKOS000277132|NSC-710599|NCGC00017345-01|NCGC00161832-01|AC-34220|B3943|CS-0019502|A16907|C22152|Q568006|(E)-4-(3,7-dimethylocta-2,6-dienyloxy)-7H-furo[3,2-g]chromen-7-one|4-([(2E)-3,7-dimethyl-2,6-octadienyl]oxy)-7h-furo[3,2-g]chromen-7-one

Structure
3D structure 2D structure
5471349
Predicted properties (NCBI Pubchem)

Physicochemical Properties