6-Methoxy-4,7-dimethyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-ol

Details

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Internal ID 8c5f4992-4928-4442-9861-5507e1a59c00
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name 6-methoxy-4,7-dimethyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-ol
SMILES (Canonical) CC1CC(C(C2=C1C=C(C(=C2)C)OC)C(C)C)O
SMILES (Isomeric) CC1CC(C(C2=C1C=C(C(=C2)C)OC)C(C)C)O
InChI InChI=1S/C16H24O2/c1-9(2)16-13-6-11(4)15(18-5)8-12(13)10(3)7-14(16)17/h6,8-10,14,16-17H,7H2,1-5H3
InChI Key SGRUYFUVJPWQIO-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C16H24O2
Molecular Weight 248.36 g/mol
Exact Mass 248.177630004 g/mol
Topological Polar Surface Area (TPSA) 29.50 Ų
XlogP 3.70

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 6-Methoxy-4,7-dimethyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-ol

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
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 97.58% 85.14%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.60% 96.09%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 92.78% 89.62%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 92.14% 91.11%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 86.58% 95.89%
CHEMBL2581 P07339 Cathepsin D 85.85% 98.95%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 85.42% 97.23%
CHEMBL3137262 O60341 LSD1/CoREST complex 83.98% 97.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 83.73% 95.56%
CHEMBL4208 P20618 Proteasome component C5 83.13% 90.00%
CHEMBL241 Q14432 Phosphodiesterase 3A 82.67% 92.94%
CHEMBL5608 Q16288 NT-3 growth factor receptor 82.54% 95.89%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 82.25% 97.14%
CHEMBL1293249 Q13887 Kruppel-like factor 5 81.64% 86.33%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 81.43% 97.21%
CHEMBL2781 P19634 Sodium/hydrogen exchanger 1 81.17% 90.24%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 81.15% 90.71%

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 74051574
LOTUS LTS0092129
wikiData Q105252570