(3R,5S)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene
Internal ID | cb6fa397-7275-446f-803b-7bfb76730373 |
Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids |
IUPAC Name | (3R,5S)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene |
SMILES (Canonical) | CC1CCC=C2C1(CC(CC2)C(=C)C)C |
SMILES (Isomeric) | C[C@H]1CCC=C2C1(C[C@@H](CC2)C(=C)C)C |
InChI | InChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7,12-13H,1,5-6,8-10H2,2-4H3/t12-,13+,15?/m0/s1 |
InChI Key | QEBNYNLSCGVZOH-IKCIUXDWSA-N |
Popularity | 0 references in papers |
Molecular Formula | C15H24 |
Molecular Weight | 204.35 g/mol |
Exact Mass | 204.187800766 g/mol |
Topological Polar Surface Area (TPSA) | 0.00 Ų |
XlogP | 5.20 |
There are no found synonyms. |
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
Proven Targets:
CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
---|---|---|---|---|---|
No proven targets yet! |
Predicted Targets (via Super-PRED):
CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
---|---|---|---|---|
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.26% | 91.11% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.59% | 96.09% |
CHEMBL1951 | P21397 | Monoamine oxidase A | 92.57% | 91.49% |
CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 92.53% | 97.25% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 90.97% | 100.00% |
CHEMBL4040 | P28482 | MAP kinase ERK2 | 88.79% | 83.82% |
CHEMBL241 | Q14432 | Phosphodiesterase 3A | 88.07% | 92.94% |
CHEMBL3137262 | O60341 | LSD1/CoREST complex | 87.04% | 97.09% |
CHEMBL1871 | P10275 | Androgen Receptor | 84.02% | 96.43% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.47% | 95.89% |
CHEMBL4208 | P20618 | Proteasome component C5 | 81.78% | 90.00% |
CHEMBL2581 | P07339 | Cathepsin D | 81.34% | 98.95% |
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.
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PubChem | 5317160 |
LOTUS | LTS0242950 |
wikiData | Q104667258 |