1,6-dimethyl-4-prop-1-en-2-yl-4a,5,6,7,8,8a-hexahydro-4H-naphthalen-1-ol

Details

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Internal ID 3561f97d-b35b-47de-a396-294bfafe594c
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name 1,6-dimethyl-4-prop-1-en-2-yl-4a,5,6,7,8,8a-hexahydro-4H-naphthalen-1-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H24O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h7-8,11-14,16H,1,5-6,9H2,2-4H3
InChI Key NQKWUNQUPNPCCJ-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H24O
Molecular Weight 220.35 g/mol
Exact Mass 220.182715385 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 4.20

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 1,6-dimethyl-4-prop-1-en-2-yl-4a,5,6,7,8,8a-hexahydro-4H-naphthalen-1-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 96.68% 96.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 95.82% 97.25%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.32% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 92.25% 91.49%
CHEMBL1994 P08235 Mineralocorticoid receptor 90.11% 100.00%
CHEMBL4040 P28482 MAP kinase ERK2 89.76% 83.82%
CHEMBL241 Q14432 Phosphodiesterase 3A 89.50% 92.94%
CHEMBL3137262 O60341 LSD1/CoREST complex 85.58% 97.09%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 83.84% 85.14%
CHEMBL1871 P10275 Androgen Receptor 83.49% 96.43%
CHEMBL2996 Q05655 Protein kinase C delta 81.41% 97.79%
CHEMBL4187 Q99250 Sodium channel protein type II alpha subunit 80.97% 95.50%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.51% 86.33%

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 73158282
LOTUS LTS0167575
wikiData Q105183924