AromaDb: A Database of Plant's Aroma Molecules

Benzophenone Details

: IUPAC Name
:Chemical Class
:CAS Registry Number
119-61-9
:Description

:Fragrance Type
floral

Physical and Chemical properties

PUBCHEM ID3102
Molecular Weight (mg/mol)182.223
Molecular FormulaC13H10O
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
IUPAC Name
Canonical SMILESO=C(c1ccccc1)c2ccccc2
PUBCHEM IUPAC INCHIKEYRWCCWEUUXYIKHB-UHFFFAOYSA-N
Solubility Level3
Vapour Pressure-2.662

Absorption and Metabolism information

XLOGP3 AANA
CACTVS TPSA54.37
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP983.234
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDANon-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD501.58636
Ocular IrritancyNone
Hepatotoxic#Prediction1
Effected Human GenesNA

Ecological Information

Aerobic Biodegradability PredictionNon-Degradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards None
Environmental hazardsnot classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
1 119-61-9 ALDH1A1 Rattus norvegicus benzophenone results in increased expression of ALDH1A1 mRNA increases^expression 22584684
2 119-61-9 ALDH1A1 Rattus norvegicus benzophenone results in increased expression of ALDH1A1 mRNA increases^expression 22584684
3 119-61-9 ANAPC11 Rattus norvegicus benzophenone results in decreased expression of ANAPC11 mRNA decreases^expression 22584684
4 119-61-9 ANAPC11 Rattus norvegicus benzophenone results in decreased expression of ANAPC11 mRNA decreases^expression 22584684
5 119-61-9 AR Rattus norvegicus benzophenone binds to AR protein affects^binding 14565775
6 119-61-9 AR Rattus norvegicus benzophenone binds to AR protein affects^binding 14565775
7 119-61-9 CCNB1 Rattus norvegicus benzophenone results in increased expression of CCNB1 mRNA increases^expression 22584684
8 119-61-9 CCNB1 Rattus norvegicus benzophenone results in increased expression of CCNB1 mRNA increases^expression 22584684
9 119-61-9 CDK1 Rattus norvegicus benzophenone results in increased expression of CDK1 mRNA increases^expression 22584684
10 119-61-9 CDK1 Rattus norvegicus benzophenone results in increased expression of CDK1 mRNA increases^expression 22584684
11 119-61-9 CYP2B1 Rattus norvegicus benzophenone results in increased expression of CYP2B1 increases^expression 22584684
12 119-61-9 CYP2B1 Rattus norvegicus benzophenone results in increased expression of CYP2B1 increases^expression 22584684
13 119-61-9 CYP2B1 Rattus norvegicus benzophenone results in increased expression of CYP2B1 mRNA increases^expression 14613717
14 119-61-9 CYP2B1 Rattus norvegicus benzophenone results in increased expression of CYP2B1 mRNA increases^expression 14613717
15 119-61-9 CYP2B2 Rattus norvegicus benzophenone results in increased expression of CYP2B2 mRNA increases^expression 14613717
16 119-61-9 CYP2B2 Rattus norvegicus benzophenone results in increased expression of CYP2B2 mRNA increases^expression 14613717
17 119-61-9 CYP2C11 Rattus norvegicus benzophenone results in increased expression of CYP2C11 mRNA increases^expression 14613717
18 119-61-9 CYP2C11 Rattus norvegicus benzophenone results in increased expression of CYP2C11 mRNA increases^expression 14613717
19 119-61-9 CYP3A23/3A1 Rattus norvegicus benzophenone results in increased expression of CYP3A23/3A1 mRNA increases^expression 14613717
20 119-61-9 CYP3A23/3A1 Rattus norvegicus benzophenone results in increased expression of CYP3A23/3A1 mRNA increases^expression 14613717
21 119-61-9 ER Pimephales promelas benzophenone binds to and results in increased activity of ER protein affects^binding|increases^activity 18992764
22 119-61-9 ER Pimephales promelas benzophenone binds to and results in increased activity of ER protein affects^binding|increases^activity 18992764
23 119-61-9 ESR1 Homo sapiens benzophenone binds to and results in increased activity of ESR1 protein affects^binding|increases^activity 16079615|27633901
24 119-61-9 ESR1 Homo sapiens benzophenone binds to and results in increased activity of ESR1 protein affects^binding|increases^activity 16079615|27633901
25 119-61-9 ESR2 Homo sapiens benzophenone binds to and results in increased activity of ESR2 protein affects^binding|increases^activity 16079615|27633901
26 119-61-9 ESR2 Homo sapiens benzophenone binds to and results in increased activity of ESR2 protein affects^binding|increases^activity 16079615|27633901
27 119-61-9 ESR2 Homo sapiens benzophenone binds to ESR2 protein affects^binding 12224631
28 119-61-9 ESR2 Homo sapiens benzophenone binds to ESR2 protein affects^binding 12224631
29 119-61-9 FOS Homo sapiens benzophenone results in increased expression of FOS mRNA increases^expression 24308608
30 119-61-9 FOS Homo sapiens benzophenone results in increased expression of FOS mRNA increases^expression 24308608
31 119-61-9 FOS Homo sapiens benzophenone results in increased expression of FOS protein increases^expression 24308608
32 119-61-9 FOS Homo sapiens benzophenone results in increased expression of FOS protein increases^expression 24308608
33 119-61-9 MIR182 Rattus norvegicus benzophenone results in increased expression of MIR182 mRNA increases^expression 22584684
34 119-61-9 MIR182 Rattus norvegicus benzophenone results in increased expression of MIR182 mRNA increases^expression 22584684
35 119-61-9 MIR200A Rattus norvegicus benzophenone results in increased expression of MIR200A mRNA increases^expression 22584684
36 119-61-9 MIR200A Rattus norvegicus benzophenone results in increased expression of MIR200A mRNA increases^expression 22584684
37 119-61-9 MIR200B Rattus norvegicus benzophenone results in increased expression of MIR200B mRNA increases^expression 22584684
38 119-61-9 MIR200B Rattus norvegicus benzophenone results in increased expression of MIR200B mRNA increases^expression 22584684
39 119-61-9 MIR221 Rattus norvegicus benzophenone results in decreased expression of MIR221 mRNA decreases^expression 22584684
40 119-61-9 MIR221 Rattus norvegicus benzophenone results in decreased expression of MIR221 mRNA decreases^expression 22584684
41 119-61-9 MIR429 Rattus norvegicus benzophenone results in increased expression of MIR429 mRNA increases^expression 22584684
42 119-61-9 MIR429 Rattus norvegicus benzophenone results in increased expression of MIR429 mRNA increases^expression 22584684
43 119-61-9 MIR96 Rattus norvegicus benzophenone results in increased expression of MIR96 mRNA increases^expression 22584684
44 119-61-9 MIR96 Rattus norvegicus benzophenone results in increased expression of MIR96 mRNA increases^expression 22584684
45 119-61-9 NR1I2 Rattus norvegicus benzophenone binds to and results in increased activity of NR1I2 protein affects^binding|increases^activity 14613717
46 119-61-9 NR1I2 Rattus norvegicus benzophenone binds to and results in increased activity of NR1I2 protein affects^binding|increases^activity 14613717
47 119-61-9 NUSAP1 Rattus norvegicus benzophenone results in increased expression of NUSAP1 mRNA increases^expression 22584684
48 119-61-9 NUSAP1 Rattus norvegicus benzophenone results in increased expression of NUSAP1 mRNA increases^expression 22584684
49 119-61-9 STEAP3 Rattus norvegicus benzophenone results in decreased expression of STEAP3 mRNA decreases^expression 22584684
50 119-61-9 STEAP3 Rattus norvegicus benzophenone results in decreased expression of STEAP3 mRNA decreases^expression 22584684
51 119-61-9 STMN1 Rattus norvegicus benzophenone results in increased expression of STMN1 mRNA increases^expression 22584684
52 119-61-9 STMN1 Rattus norvegicus benzophenone results in increased expression of STMN1 mRNA increases^expression 22584684
53 119-61-9 TPO Homo sapiens benzophenone results in decreased activity of TPO protein decreases^activity 21809831
54 119-61-9 TPO Homo sapiens benzophenone results in decreased activity of TPO protein decreases^activity 21809831
55 119-61-9 TXNL4B Rattus norvegicus benzophenone results in increased expression of TXNL4B mRNA increases^expression 22584684
56 119-61-9 TXNL4B Rattus norvegicus benzophenone results in increased expression of TXNL4B mRNA increases^expression 22584684
57 119-61-9 VTG Pimephales promelas benzophenone results in increased expression of VTG protein increases^expression 18992764
58 119-61-9 VTG Pimephales promelas benzophenone results in increased expression of VTG protein increases^expression 18992764
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 119-61-9 Benzophenone
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