Nymphaeol A structure

Nymphaeol A

(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

Also Known As: NYMPHAEOL A|Propolin C|diplacone|6-Geranyl eriodictyol|6-geranyl-3',4',5,7-tetrahydroxyflavanone|J2.505.235H|(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one|(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|(2S)-6-(3,7-Dimethyl-2,6-octadienyl)-3 ,4 ,5,7-tetrahydroxy-2,3-dihydroflavone|(2S)-2-(3,4-dihydroxyphenyl)-6-((2E)-3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|(2S)-2-(3,4-dihydroxyphenyl)-6-((2E)-3,7-dimethylocta-2,6-dienyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one|(2S)-2-(3,4-dihydroxyphenyl)-6-(3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one|(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one|(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-chroman-4-one|(2S)-2alpha-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-(3,7-dimethyl-2,6-octadienyl)-3,4-dihydro-2H-1-benzopyran-4-one|(2S)-2alpha-(3,4-Dihydroxyphenyl)-6-[(E)-3,7-dimethyl-2,6-octadienyl]-2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-6-(3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-(3,7-dimethyl-2,6-octadienyl)-2,3-dihydro-5,7-dihydroxy-, (2S)-|6-[(E)-3,7-Dimethyl-2,6-octadienyl]-2alpha-(3,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one

CAS: 73676-38-7
Molecular Formula C25H28O6
Molecular Weight 424.1886 g/mol
LogP 5.8
Topological Polar Surface Area 107.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 424.1886
Monoisotopic Mass 424.1886
Heavy Atoms 31
Complexity 681.0

Chemical Identifiers

CAS Number 73676-38-7
SMILES CC(=CCC/C(=C/CC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC(=C(C=C3)O)O)O)/C)C
InChIKey XCYSQFHYFNWYFP-CEMXSPGASA-N

Product Overview

Nymphaeol A (CAS 73676-38-7), with molecular formula C25H28O6 and molecular weight 424.1886 g/mol. IUPAC: (2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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