N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-methyldec-6-enamide

Details

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Internal ID 8571b7e1-89e0-41dc-8a93-e800f6a73b5d
Taxonomy Benzenoids > Phenols > Methoxyphenols
IUPAC Name N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-methyldec-6-enamide
SMILES (Canonical) CC(C)CC=CCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
SMILES (Isomeric) CC(C)CC=CCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
InChI InChI=1S/C19H29NO3/c1-15(2)9-7-5-4-6-8-10-19(22)20-14-16-11-12-17(21)18(13-16)23-3/h5,7,11-13,15,21H,4,6,8-10,14H2,1-3H3,(H,20,22)
InChI Key JZNZUOZRIWOBGG-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C19H29NO3
Molecular Weight 319.40 g/mol
Exact Mass 319.21474379 g/mol
Topological Polar Surface Area (TPSA) 58.60 Ų
XlogP 4.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-methyldec-6-enamide

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 99.50% 91.11%
CHEMBL3060 Q9Y345 Glycine transporter 2 99.08% 99.17%
CHEMBL2581 P07339 Cathepsin D 98.97% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.98% 96.09%
CHEMBL1255126 O15151 Protein Mdm4 95.39% 90.20%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 94.82% 94.45%
CHEMBL2535 P11166 Glucose transporter 93.84% 98.75%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.74% 95.56%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 90.73% 97.29%
CHEMBL3492 P49721 Proteasome Macropain subunit 89.91% 90.24%
CHEMBL4208 P20618 Proteasome component C5 89.84% 90.00%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 88.23% 96.00%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 86.76% 95.50%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 85.98% 90.71%
CHEMBL5701 Q9H2K8 Serine/threonine-protein kinase TAO3 84.28% 96.67%
CHEMBL1744525 P43490 Nicotinamide phosphoribosyltransferase 84.04% 96.25%
CHEMBL2179 P04062 Beta-glucocerebrosidase 83.51% 85.31%
CHEMBL1907605 P24864 Cyclin-dependent kinase 2/cyclin E1 83.37% 92.88%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 82.82% 99.15%
CHEMBL3401 O75469 Pregnane X receptor 82.63% 94.73%
CHEMBL5261 Q7L7X3 Serine/threonine-protein kinase TAO1 82.11% 89.33%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 81.94% 97.21%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 80.89% 100.00%
CHEMBL3891 P07384 Calpain 1 80.23% 93.04%
CHEMBL5163 Q9NY46 Sodium channel protein type III alpha subunit 80.14% 96.90%

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.
Capsicum annuum
Viburnum luzonicum

Cross-Links

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PubChem 78070862
LOTUS LTS0072128
wikiData Q105219044