(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene

Details

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Internal ID 031fdbfe-0aec-47d6-8ea9-dcb8bcde7a85
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H22O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)8-15(13)14/h7-11H,6H2,1-5H3/t11-/m1/s1
InChI Key VMTKGTHHOWQTRO-LLVKDONJSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C16H22O
Molecular Weight 230.34 g/mol
Exact Mass 230.167065321 g/mol
Topological Polar Surface Area (TPSA) 9.20 Ų
XlogP 4.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.62% 96.09%
CHEMBL2581 P07339 Cathepsin D 91.86% 98.95%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 91.04% 89.62%
CHEMBL1907 P15144 Aminopeptidase N 88.57% 93.31%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.35% 95.56%
CHEMBL2535 P11166 Glucose transporter 86.23% 98.75%
CHEMBL4302 P08183 P-glycoprotein 1 85.85% 92.98%
CHEMBL5608 Q16288 NT-3 growth factor receptor 84.83% 95.89%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 84.50% 97.21%
CHEMBL1293249 Q13887 Kruppel-like factor 5 83.79% 86.33%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 83.78% 97.14%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 83.60% 90.71%
CHEMBL2781 P19634 Sodium/hydrogen exchanger 1 82.54% 90.24%
CHEMBL3137262 O60341 LSD1/CoREST complex 82.28% 97.09%
CHEMBL4444 P04070 Vitamin K-dependent protein C 82.27% 93.89%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 82.16% 91.11%
CHEMBL5203 P33316 dUTP pyrophosphatase 82.11% 99.18%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 82.09% 99.15%
CHEMBL4581 P52732 Kinesin-like protein 1 81.99% 93.18%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 81.39% 97.23%
CHEMBL3492 P49721 Proteasome Macropain subunit 81.29% 90.24%
CHEMBL3359 P21462 Formyl peptide receptor 1 80.96% 93.56%
CHEMBL2337 P48067 Glycine transporter 1 80.14% 95.45%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 80.09% 96.21%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 162910132
LOTUS LTS0134720
wikiData Q105289283