5,7-Dimethoxy-2-phenyl-3-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalen-1-ol

Details

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Internal ID 8812b404-a005-4969-9b18-30d47b74470b
Taxonomy Benzenoids > Naphthalenes > Phenylnaphthalenes
IUPAC Name 5,7-dimethoxy-2-phenyl-3-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILES (Canonical) CC(=C)C1CC2=C(C=C(C=C2OC)OC)C(C1C3=CC=CC=C3)O
SMILES (Isomeric) CC(=C)C1CC2=C(C=C(C=C2OC)OC)C(C1C3=CC=CC=C3)O
InChI InChI=1S/C21H24O3/c1-13(2)16-12-17-18(10-15(23-3)11-19(17)24-4)21(22)20(16)14-8-6-5-7-9-14/h5-11,16,20-22H,1,12H2,2-4H3
InChI Key FOIFXGNTOSLLEH-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C21H24O3
Molecular Weight 324.40 g/mol
Exact Mass 324.17254462 g/mol
Topological Polar Surface Area (TPSA) 38.70 Ų
XlogP 4.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 5,7-Dimethoxy-2-phenyl-3-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalen-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 97.00% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.81% 91.11%
CHEMBL240 Q12809 HERG 94.50% 89.76%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.08% 95.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.59% 86.33%
CHEMBL5608 Q16288 NT-3 growth factor receptor 89.30% 95.89%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 88.76% 85.14%
CHEMBL2535 P11166 Glucose transporter 86.00% 98.75%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 84.48% 92.62%
CHEMBL2056 P21728 Dopamine D1 receptor 82.92% 91.00%
CHEMBL2581 P07339 Cathepsin D 82.66% 98.95%
CHEMBL3714130 P46095 G-protein coupled receptor 6 82.41% 97.36%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.78% 99.17%
CHEMBL1951 P21397 Monoamine oxidase A 80.73% 91.49%

Plants that contains it

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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.
Carex distachya

Cross-Links

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PubChem 73050199
LOTUS LTS0073284
wikiData Q104998785