Triacsin D

Details

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Internal ID f2aeae4a-183c-4045-baff-37da024749f5
Taxonomy Organic nitrogen compounds > Organonitrogen compounds > Organic nitroso compounds > Organic N-nitroso compounds
IUPAC Name N-[(E)-[(2E,4E,6E)-undeca-2,4,6-trienylidene]amino]nitrous amide
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C11H17N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h5-11H,2-4H2,1H3,(H,13,15)/b6-5+,8-7+,10-9+,12-11+
InChI Key LHUQTZGIUIKTLZ-AQPMYLLTSA-N
Popularity 11 references in papers

Physical and Chemical Properties

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Molecular Formula C11H17N3O
Molecular Weight 207.27 g/mol
Exact Mass 207.137162174 g/mol
Topological Polar Surface Area (TPSA) 53.80 Ų
XlogP 3.70

Synonyms

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WS-1228B
76896-81-6
N-[(E)-[(2E,4E,6E)-undeca-2,4,6-trienylidene]amino]nitrous amide
N-((E)-((2E,4E,6E)-undeca-2,4,6-trienylidene)amino)nitrous amide
RefChem:190813
2,4,6-Undecatrienal, nitrosohydrazone, (2,E,E,E)-
WS-1228 B
WS 1228B
WS 1228 B
FR 900184
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Triacsin D

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
CHEMBL230 P35354 Cyclooxygenase-2 96.68% 89.63%
CHEMBL2581 P07339 Cathepsin D 90.15% 98.95%
CHEMBL240 Q12809 HERG 89.88% 89.76%
CHEMBL3060 Q9Y345 Glycine transporter 2 88.44% 99.17%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 85.12% 97.29%
CHEMBL299 P17252 Protein kinase C alpha 83.90% 98.03%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 83.77% 89.34%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 82.48% 96.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 82.45% 96.09%
CHEMBL1907605 P24864 Cyclin-dependent kinase 2/cyclin E1 82.41% 92.88%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 81.70% 92.08%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 80.53% 96.00%

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 9576837
LOTUS LTS0212147
wikiData Q76404722