PUBCHEM ID | 2879 |
Molecular Weight (g/mol) | 108.138 |
Molecular Formula | C7H8O |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 0 |
IUPAC Name | 4-methylphenol |
Canonical SMILES | Cc1ccc(O)cc1 |
PUBCHEM IUPAC INCHIKEY | IWDCLRJOBJJRNH-UHFFFAOYSA-N |
Solubility Level | 4 |
Vapour Pressure | -0.929 |
XLOGP3 AA | |
CACTVS TPSA | 20.2 |
BBB Level | 1 |
Absorption Level | 0 |
EXT PPB#Prediction | 1 |
AlogP98 | 2.074 |
EXT CYP2D6#Prediction | 0 |
Mouse Female FDA | Non-Carcinogen |
Mouse Male FDA | Multi-Carcinogen |
Rat Female FDA | Multi-Carcinogen |
Rat Male FDA | Multi-Carcinogen |
Ames Prediction | Non-Mutagen |
Developmental / Reproductive Toxicity | Toxic |
Rat Oral LD50 | 1.49231 g/kg_body_weight |
Ocular Irritancy | Severe |
Hepatotoxic#Prediction | 1 |
Effected Human Genes |
Aerobic Biodegradability Prediction | Non-Degradable |
Physical hazards | not classified |
Health hazards | Mild |
Environmental hazards | not classified |
Serial No. | Cas No | Gene Symbol | Organism | Interaction | Interaction Actions | PubMed Id |
---|---|---|---|---|---|---|
1 | 106-44-5 | ALB | Homo sapiens | 4-cresol binds to ALB protein | affects^binding | 11334365 |
2 | 106-44-5 | BECN1 | Homo sapiens | 4-cresol results in increased expression of BECN1 protein | increases^expression | 25668154 |
3 | 106-44-5 | BECN1 | Rattus norvegicus | 4-cresol results in increased expression of BECN1 | increases^expression | 25668154 |
4 | 106-44-5 | CASP3 | Homo sapiens | 4-cresol results in increased activity of CASP3 protein | increases^activity | 25668154 |
5 | 106-44-5 | CDH2 | Rattus norvegicus | 4-cresol inhibits the reaction [CTNND1 protein binds to CDH2 protein] | affects^binding|decreases^reaction | 23466501 |
6 | 106-44-5 | CDH2 | Rattus norvegicus | Go 6976 inhibits the reaction [4-cresol inhibits the reaction [CTNND1 protein binds to CDH2 protein]] | affects^binding|decreases^reaction | 23466501 |
7 | 106-44-5 | CX3CL1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of CX3CL1 protein] | decreases^reaction|increases^expression | 16954166 |
8 | 106-44-5 | DBH | Bos taurus | 4-cresol results in decreased activity of DBH protein | decreases^activity | 2306476 |
9 | 106-44-5 | F11R | Homo sapiens | 4-cresol results in decreased expression of F11R protein | decreases^expression | 16954166 |
10 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of ICAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
11 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of ICAM1 protein] | decreases^reaction|increases^expression | 12427124 |
12 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of ICAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
13 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of ICAM1 protein] | decreases^reaction|increases^expression | 12427124 |
14 | 106-44-5 | IL1B | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of VCAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
15 | 106-44-5 | IL1B | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of VCAM1 protein] | decreases^reaction|increases^expression | 12427124 |
16 | 106-44-5 | MPO | 4-cresol binds to MPO protein | affects^binding | 8132563 | |
17 | 106-44-5 | PRKCA | Rattus norvegicus | 4-cresol results in increased phosphorylation of and results in increased activity of PRKCA protein | increases^activity|increases^phosphorylation | 23466501 |
18 | 106-44-5 | PRKCA | Rattus norvegicus | PRKCA protein results in increased susceptibility to 4-cresol | increases^response to substance | 22813906 |
19 | 106-44-5 | PRKCA | 1,2-bis(2-aminophenoxy)ethane N,N,N',N'-tetraacetic acid acetoxymethyl ester inhibits the reaction [4-cresol results in increased activity of PRKCA protein] | decreases^reaction|increases^activity | 23466501 | |
20 | 106-44-5 | PTGS1 | Oryctolagus cuniculus | 4-cresol results in decreased activity of PTGS1 protein | decreases^activity | 15664436 |
21 | 106-44-5 | SQSTM1 | Homo sapiens | 4-cresol results in increased expression of SQSTM1 protein | increases^expression | 25668154 |
22 | 106-44-5 | TNF | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of VCAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
23 | 106-44-5 | TNF | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of VCAM1 protein] | decreases^reaction|increases^expression | 12427124 |
24 | 106-44-5 | ALB | Homo sapiens | 4-cresol binds to ALB protein | affects^binding | 11334365 |
25 | 106-44-5 | BECN1 | Homo sapiens | 4-cresol results in increased expression of BECN1 protein | increases^expression | 25668154 |
26 | 106-44-5 | BECN1 | Rattus norvegicus | 4-cresol results in increased expression of BECN1 | increases^expression | 25668154 |
27 | 106-44-5 | CASP3 | Homo sapiens | 4-cresol results in increased activity of CASP3 protein | increases^activity | 25668154 |
28 | 106-44-5 | CDH2 | Rattus norvegicus | 4-cresol inhibits the reaction [CTNND1 protein binds to CDH2 protein] | affects^binding|decreases^reaction | 23466501 |
29 | 106-44-5 | CDH2 | Rattus norvegicus | Go 6976 inhibits the reaction [4-cresol inhibits the reaction [CTNND1 protein binds to CDH2 protein]] | affects^binding|decreases^reaction | 23466501 |
30 | 106-44-5 | CX3CL1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of CX3CL1 protein] | decreases^reaction|increases^expression | 16954166 |
31 | 106-44-5 | DBH | Bos taurus | 4-cresol results in decreased activity of DBH protein | decreases^activity | 2306476 |
32 | 106-44-5 | F11R | Homo sapiens | 4-cresol results in decreased expression of F11R protein | decreases^expression | 16954166 |
33 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of ICAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
34 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of ICAM1 protein] | decreases^reaction|increases^expression | 12427124 |
35 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of ICAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
36 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of ICAM1 protein] | decreases^reaction|increases^expression | 12427124 |
37 | 106-44-5 | IL1B | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of VCAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
38 | 106-44-5 | IL1B | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of VCAM1 protein] | decreases^reaction|increases^expression | 12427124 |
39 | 106-44-5 | MPO | 4-cresol binds to MPO protein | affects^binding | 8132563 | |
40 | 106-44-5 | PRKCA | Rattus norvegicus | 4-cresol results in increased phosphorylation of and results in increased activity of PRKCA protein | increases^activity|increases^phosphorylation | 23466501 |
41 | 106-44-5 | PRKCA | Rattus norvegicus | PRKCA protein results in increased susceptibility to 4-cresol | increases^response to substance | 22813906 |
42 | 106-44-5 | PRKCA | 1,2-bis(2-aminophenoxy)ethane N,N,N',N'-tetraacetic acid acetoxymethyl ester inhibits the reaction [4-cresol results in increased activity of PRKCA protein] | decreases^reaction|increases^activity | 23466501 | |
43 | 106-44-5 | PTGS1 | Oryctolagus cuniculus | 4-cresol results in decreased activity of PTGS1 protein | decreases^activity | 15664436 |
44 | 106-44-5 | SQSTM1 | Homo sapiens | 4-cresol results in increased expression of SQSTM1 protein | increases^expression | 25668154 |
45 | 106-44-5 | TNF | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of VCAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
46 | 106-44-5 | TNF | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of VCAM1 protein] | decreases^reaction|increases^expression | 12427124 |
47 | 106-44-5 | ALB | Homo sapiens | 4-cresol binds to ALB protein | affects^binding | 11334365 |
48 | 106-44-5 | BECN1 | Homo sapiens | 4-cresol results in increased expression of BECN1 protein | increases^expression | 25668154 |
49 | 106-44-5 | BECN1 | Rattus norvegicus | 4-cresol results in increased expression of BECN1 | increases^expression | 25668154 |
50 | 106-44-5 | CASP3 | Homo sapiens | 4-cresol results in increased activity of CASP3 protein | increases^activity | 25668154 |
51 | 106-44-5 | CDH2 | Rattus norvegicus | 4-cresol inhibits the reaction [CTNND1 protein binds to CDH2 protein] | affects^binding|decreases^reaction | 23466501 |
52 | 106-44-5 | CDH2 | Rattus norvegicus | Go 6976 inhibits the reaction [4-cresol inhibits the reaction [CTNND1 protein binds to CDH2 protein]] | affects^binding|decreases^reaction | 23466501 |
53 | 106-44-5 | CX3CL1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of CX3CL1 protein] | decreases^reaction|increases^expression | 16954166 |
54 | 106-44-5 | DBH | Bos taurus | 4-cresol results in decreased activity of DBH protein | decreases^activity | 2306476 |
55 | 106-44-5 | F11R | Homo sapiens | 4-cresol results in decreased expression of F11R protein | decreases^expression | 16954166 |
56 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of ICAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
57 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of ICAM1 protein] | decreases^reaction|increases^expression | 12427124 |
58 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of ICAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
59 | 106-44-5 | ICAM1 | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of ICAM1 protein] | decreases^reaction|increases^expression | 12427124 |
60 | 106-44-5 | IL1B | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of VCAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
61 | 106-44-5 | IL1B | Homo sapiens | 4-cresol inhibits the reaction [IL1B protein results in increased expression of VCAM1 protein] | decreases^reaction|increases^expression | 12427124 |
62 | 106-44-5 | MPO | 4-cresol binds to MPO protein | affects^binding | 8132563 | |
63 | 106-44-5 | PRKCA | Rattus norvegicus | 4-cresol results in increased phosphorylation of and results in increased activity of PRKCA protein | increases^activity|increases^phosphorylation | 23466501 |
64 | 106-44-5 | PRKCA | Rattus norvegicus | PRKCA protein results in increased susceptibility to 4-cresol | increases^response to substance | 22813906 |
65 | 106-44-5 | PRKCA | 1,2-bis(2-aminophenoxy)ethane N,N,N',N'-tetraacetic acid acetoxymethyl ester inhibits the reaction [4-cresol results in increased activity of PRKCA protein] | decreases^reaction|increases^activity | 23466501 | |
66 | 106-44-5 | PTGS1 | Oryctolagus cuniculus | 4-cresol results in decreased activity of PTGS1 protein | decreases^activity | 15664436 |
67 | 106-44-5 | SQSTM1 | Homo sapiens | 4-cresol results in increased expression of SQSTM1 protein | increases^expression | 25668154 |
68 | 106-44-5 | TNF | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of VCAM1 mRNA] | decreases^reaction|increases^expression | 12427124 |
69 | 106-44-5 | TNF | Homo sapiens | 4-cresol inhibits the reaction [TNF protein results in increased expression of VCAM1 protein] | decreases^reaction|increases^expression | 12427124 |
Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
---|---|---|---|---|---|
1 | 106-44-5 | P-Cresol |
Serial No. | Plant Name | Variety Name | Essential Oil | Compound Percentage |
---|---|---|---|---|
1 | Scotch spearmint | Mukta | Mentha X gracilis Mukta essential oil |