AromaDb: A Database of Plant's Aroma Molecules

Dihydronaringenin Details

: IUPAC Name
3-4-Hydroxy-phenyl-1-2,4,6-trihydroxy-phenyl-propan-1-one
:Chemical Class
:CAS Registry Number
60-82-2
:Description

:Fragrance Type
Sweet aroma

Physical and Chemical properties

PUBCHEM ID 4788
Molecular Weight (g/mol) 274.277
Molecular Formula C15H14O5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 8
IUPAC Name 3-4-Hydroxy-phenyl-1-2,4,6-trihydroxy-phenyl-propan-1-one
Canonical SMILES O=C(CCc1ccc(O)cc1)c2c(O)cc(O)cc2O
PUBCHEM IUPAC INCHIKEY VGEREEWJJVICBM-UHFFFAOYSA-N
Solubility Level 3
Vapour Pressure -10.014

Absorption and Metabolism information

XLOGP3 AA NA
CACTVS TPSA 38.69
BBB Level 3
Absorption Level 0
EXT PPB#Prediction 0
AlogP98 2.757
EXT CYP2D6#Prediction 1

Toxicological Information

Mouse Female FDA Non-Carcinogen
Mouse Male FDA Non-Carcinogen
Rat Female FDA Non-Carcinogen
Rat Male FDA Non-Carcinogen
Ames Prediction Non-Mutagen
Developmental / Reproductive Toxicity Toxic
Rat Oral LD50 4.875
Ocular Irritancy Severe
Hepatotoxic#Prediction 1
Effected Human Genes NA

Ecological Information

Aerobic Biodegradability Prediction Non-Degradable

Hazard(s) Identification

Physical hazards not classified
Health hazards None
Environmental hazards not classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteractionInteraction Actions PubMed Id
160-82-2AFPRattus norvegicusPhloretin binds to AFP protein affects^binding 23013281|25349334
260-82-2AQP9Rattus norvegicusPhloretin results in decreased activity of AQP9 protein decreases^activity 21259319|9733774
360-82-2CCL2Homo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of CCL2 protein] decreases^reaction|increases^expression 24707119
460-82-2CCL5Homo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of CCL5 protein] decreases^reaction|increases^expression 24707119
560-82-2CSF3Homo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of CSF3 protein] decreases^reaction|increases^expression 24707119
660-82-2CYP1A1Homo sapiensPhloretin inhibits the reaction [Tetrachlorodibenzodioxin results in increased activity of CYP1A1 protein] decreases^reaction|increases^activity 17177569
760-82-2CYP1A1Homo sapiensPhloretin inhibits the reaction [Tetrachlorodibenzodioxin results in increased expression of CYP1A1 mRNA] decreases^reaction|increases^expression 17177569
860-82-2CYP1A1Homo sapiensPhloretin inhibits the reaction [Tetrachlorodibenzodioxin results in increased expression of CYP1A1 protein] decreases^reaction|increases^expression 17177569
960-82-2ESR1Homo sapiensPhloretin binds to and results in increased activity of ESR1 protein affects^binding|increases^activity 9751507
1060-82-2ESR2Homo sapiensPhloretin binds to and results in increased activity of ESR2 protein affects^binding|increases^activity 9751507
1160-82-2ESR2Homo sapiensPhloretin binds to ESR2 protein affects^binding 12224631
1260-82-2GSK3BHomo sapiensPhloretin results in decreased activity of GSK3B protein decreases^activity 16968061
1360-82-2IFNGHomo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of IFNG protein] decreases^reaction|increases^expression 24707119
1460-82-2IL10Homo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of IL10 protein] decreases^reaction|increases^expression 24707119
1560-82-2IL1AHomo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of IL1A protein] decreases^reaction|increases^expression 24707119
1660-82-2IL1RNHomo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of IL1RN protein] decreases^reaction|increases^expression 24707119
1760-82-2IL6Homo sapiensPhloretin inhibits the reaction [Lipopolysaccharides results in increased expression of IL6 protein] decreases^reaction|increases^expression 24707119
1860-82-2INSHomo sapiensPhloretin inhibits the reaction [[chromic chloride results in increased activity of INS protein modified form] which results in increased secretion of Adenosine Triphosphate] decreases^reaction|increases^activity|increases^secretion 17965850
1960-82-2KCNMA1Rattus norvegicusKCNMA1 mRNA affects the susceptibility to Phloretin affects^response to substance 19247476
2060-82-2LTFRattus norvegicusPhloretin results in increased expression of LTF protein increases^expression 24487097
2160-82-2NOS3Homo sapiensPhloretin inhibits the reaction [Hydrogen Peroxide results in increased expression of NOS3 mRNA] decreases^reaction|increases^expression 20021702
2260-82-2NOS3Homo sapiensPhloretin results in decreased expression of NOS3 mRNA decreases^expression 20021702
2360-82-2SHBGHomo sapiensPhloretin binds to SHBG protein affects^binding 25349334
2460-82-2SLC16A1Rattus norvegicus[[Luteolin co-treated with Phloretin] results in decreased activity of SLC16A1 protein] which results in decreased uptake of Sodium Oxybate affects^cotreatment|decreases^activity|decreases^uptake 17108059
2560-82-2SLC16A1Rattus norvegicus[Phloretin results in decreased activity of SLC16A1 protein] which results in decreased uptake of Sodium Oxybate decreases^activity|decreases^uptake 17108059
2660-82-2SLC2A1Homo sapiensPhloretin results in decreased activity of SLC2A1 protein decreases^activity 14642735
2760-82-2SLC2A1Sus scrofaPhloretin promotes the reaction [Cyclosporine results in increased expression of SLC2A1 mRNA] increases^expression|increases^reaction 12081571
2860-82-2SLC2A1Sus scrofaPhloretin promotes the reaction [Cyclosporine results in increased expression of SLC2A1 protein] increases^expression|increases^reaction 12081571
2960-82-2SLC2A1Sus scrofaPhloretin results in increased expression of SLC2A1 mRNA increases^expression 12081571
3060-82-2SLC2A1Sus scrofaPhloretin results in increased expression of SLC2A1 protein increases^expression 12081571
3160-82-2SLC2A2Homo sapiensPhloretin results in decreased expression of SLC2A2 protein decreases^expression 26616219
3260-82-2SLC9A1Homo sapiensPhloretin inhibits the reaction [SLC9A1 protein alternative form affects the transport of [Sodium co-treated with Lithium]] affects^cotreatment|affects^transport|decreases^reaction 12765964
3360-82-2SLC9A1Homo sapiensPhloretin results in decreased activity of SLC9A1 protein decreases^activity 12765964
3460-82-2SLC9A1Homo sapiensPhloretin results in decreased activity of SLC9A1 protein alternative form decreases^activity 12765964
3560-82-2SLC9B2Homo sapiensPhloretin results in decreased activity of SLC9B2 protein decreases^activity 18000046
3660-82-2SLCO2B1[Phlorhizin co-treated with Phloretin co-treated with Hesperidin co-treated with Quercetin] inhibits the reaction [SLCO2B1 protein results in increased uptake of estrone sulfate] affects^cotreatment|decreases^reaction|increases^uptake 23794501
3760-82-2THRARana catesbeianaPhloretin inhibits the reaction [Triiodothyronine metabolite binds to THRA protein] affects^binding|decreases^reaction 15590988
3860-82-2THRARana catesbeianaPhloretin inhibits the reaction [Triiodothyronine metabolite results in increased expression of THRA mRNA] decreases^reaction|increases^expression 15590988
3960-82-2TYRPhloretin results in decreased activity of TYR protein decreases^activity 24613711
4060-82-2TYRphloretin isonicotinyl hydrazone results in decreased activity of TYR protein decreases^activity 24613711
Serial No. Activity Name DetailsReferences (PubMed)Other details EPA (U.S) Clinical Trials (U.S. NIH)
1 60-82-2 Dihydronaringenin
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