Anethole, (Z)-
| Internal ID | 71bc50ef-9838-41d6-ae88-39aa62eb6b55 |
| Taxonomy | Benzenoids > Phenol ethers > Anisoles |
| IUPAC Name | 1-methoxy-4-[(Z)-prop-1-enyl]benzene |
| SMILES (Canonical) | CC=CC1=CC=C(C=C1)OC |
| SMILES (Isomeric) | C/C=C\C1=CC=C(C=C1)OC |
| InChI | InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3- |
| InChI Key | RUVINXPYWBROJD-ARJAWSKDSA-N |
| Popularity | 122 references in papers |
| Molecular Formula | C10H12O |
| Molecular Weight | 148.20 g/mol |
| Exact Mass | 148.088815002 g/mol |
| Topological Polar Surface Area (TPSA) | 9.20 Ų |
| XlogP | 3.30 |
| 25679-28-1 |
| (Z)-Anethole |
| (Z)-1-Methoxy-4-(prop-1-en-1-yl)benzene |
| cis-p-Propenylanisole |
| cis-p-Anethole |
| Anethole, cis |
| (Z-)-Anethole |
| ANISOLE, p-PROPENYL-, cis- |
| Anethole, (Z)- |
| 1-methoxy-4-[(Z)-prop-1-enyl]benzene |
| There are more than 10 synonyms. If you wish to see them all click here. |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| CHEMBL4096 | P04637 | Cellular tumor antigen p53 |
5 nM 5 nM |
Potency Potency |
via CMAUP
via Super-PRED |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 |
12589.3 nM 12589.3 nM |
Potency Potency |
via CMAUP
via CMAUP |
| CHEMBL1293235 | P02545 | Prelamin-A/C |
316.2 nM 316.2 nM |
Potency Potency |
via CMAUP
via Super-PRED |
| CHEMBL1963 | P16473 | Thyroid stimulating hormone receptor |
794.3 nM 794.3 nM 794.3 nM |
Potency Potency Potency |
via CMAUP
via Super-PRED via CMAUP |
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 93.45% | 96.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 91.91% | 95.56% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 91.13% | 93.31% |
| CHEMBL2039 | P27338 | Monoamine oxidase B | 90.08% | 92.51% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 89.40% | 93.99% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 89.02% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 87.53% | 96.09% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 87.12% | 90.00% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 86.39% | 90.24% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 85.67% | 86.33% |
| CHEMBL2487 | P05067 | Beta amyloid A4 protein | 84.58% | 96.74% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| PubChem | 1549040 |
| NPASS | NPC259134 |
| ChEMBL | CHEMBL1468832 |
| LOTUS | LTS0009997 |
| wikiData | Q27147814 |