Phloretin

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Systematic / IUPAC Name: 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone

ID: Reference542

Other Names: 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one;
1-Propanone, 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-;
β-(p-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone;
β-(4-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone;
Dihydronaringenin

Formula: C15H14O5

Class: Endogenous Metabolites

Spectral Data

Phloretin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments LTQ Orbitrap XL; Orbitrap Elite
No. of Spectral Trees 4
No. of Spectra 641
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers IT; FT
Last Modification 12/12/2016 12:48:45 PM
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Identificators

InChI InChI=1S/C15H14O5/c16-10-4-1-9(2-5-10)3-6-12(18)15-13(19)7-11(17)8-14(15)20/h1-2,4-5,7-8,16-17,19-20H,3,6H2
InChI Key VGEREEWJJVICBM-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O
CAS 60822
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Other Names 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one;
1-Propanone, 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-;
β-(p-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone;
β-(4-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone;
Dihydronaringenin;
Phloretol

In Other Databases

ChEMBL CHEMBL45068
KEGG C00774
ChemIDPlus 000060822
HMDb HMDB03306
ChEBI CHEBI:17276
PubChem 4788
ChemSpider 4624
Wikipedia Phloretin