Hygrophorone F12

Details

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Internal ID 4407a260-102f-422f-96da-47c7a9d02109
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohols > Long-chain fatty alcohols
IUPAC Name (5E)-5-(2-hydroxytetradecylidene)furan-2-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-16(19)15-17-13-14-18(20)21-17/h13-16,19H,2-12H2,1H3/b17-15+
InChI Key YGIVJGMUJAYHJF-BMRADRMJSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C18H30O3
Molecular Weight 294.40 g/mol
Exact Mass 294.21949481 g/mol
Topological Polar Surface Area (TPSA) 46.50 Ų
XlogP 6.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Hygrophorone F12

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
CHEMBL2581 P07339 Cathepsin D 97.56% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 94.22% 99.17%
CHEMBL3401 O75469 Pregnane X receptor 92.48% 94.73%
CHEMBL230 P35354 Cyclooxygenase-2 92.31% 89.63%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 92.14% 92.08%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 91.68% 91.11%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 89.47% 85.94%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 87.34% 96.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.80% 95.56%
CHEMBL1907 P15144 Aminopeptidase N 86.79% 93.31%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 85.78% 91.81%
CHEMBL3359 P21462 Formyl peptide receptor 1 85.03% 93.56%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 84.90% 94.45%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 84.79% 97.29%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 84.07% 90.71%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 82.94% 100.00%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 80.99% 92.86%
CHEMBL253 P34972 Cannabinoid CB2 receptor 80.81% 97.25%

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 11737967
LOTUS LTS0219186
wikiData Q77309997