(6RS,10RS)-6,10-dimethylbicyclo(4.4.0)decan-3-ol

Details

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Internal ID 8ab0c36d-c8ca-434c-9aaa-097fb56d8be7
Taxonomy Organic oxygen compounds > Organooxygen compounds > Alcohols and polyols > Cyclic alcohols and derivatives
IUPAC Name (4aR,8R)-4a,8-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-ol
SMILES (Canonical) CC1CCCC2(C1CC(CC2)O)C
SMILES (Isomeric) C[C@@H]1CCC[C@]2(C1CC(CC2)O)C
InChI InChI=1S/C12H22O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h9-11,13H,3-8H2,1-2H3/t9-,10?,11?,12-/m1/s1
InChI Key MIVRQKTZEMHECK-HBIQZDMRSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C12H22O
Molecular Weight 182.30 g/mol
Exact Mass 182.167065321 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 3.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (6RS,10RS)-6,10-dimethylbicyclo(4.4.0)decan-3-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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.50% 96.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 92.79% 97.25%
CHEMBL3137262 O60341 LSD1/CoREST complex 90.52% 97.09%
CHEMBL241 Q14432 Phosphodiesterase 3A 88.72% 92.94%
CHEMBL6136 O60341 Lysine-specific histone demethylase 1 84.40% 95.58%
CHEMBL237 P41145 Kappa opioid receptor 83.48% 98.10%
CHEMBL1994 P08235 Mineralocorticoid receptor 82.77% 100.00%
CHEMBL4026 P40763 Signal transducer and activator of transcription 3 82.40% 82.69%
CHEMBL238 Q01959 Dopamine transporter 81.37% 95.88%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 81.22% 91.11%
CHEMBL5469 Q14289 Protein tyrosine kinase 2 beta 81.03% 91.03%
CHEMBL3045 P05771 Protein kinase C beta 80.76% 97.63%
CHEMBL259 P32245 Melanocortin receptor 4 80.64% 95.38%
CHEMBL206 P03372 Estrogen receptor alpha 80.53% 97.64%
CHEMBL2996 Q05655 Protein kinase C delta 80.49% 97.79%

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 130905004
LOTUS LTS0145870
wikiData Q77372993