Sulfinemycin

Details

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Internal ID 84986cd3-bff1-4a33-88be-7633faed1abd
Taxonomy Organosulfur compounds > Sulfines
IUPAC Name (E)-14-methyl-1-sulfinylpentadec-2-en-1-amine
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H31NOS/c1-15(2)13-11-9-7-5-3-4-6-8-10-12-14-16(17)19-18/h12,14-15H,3-11,13,17H2,1-2H3/b14-12+
InChI Key OZRWOZAJBRXGLW-WYMLVPIESA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C16H31NOS
Molecular Weight 285.50 g/mol
Exact Mass 285.21263579 g/mol
Topological Polar Surface Area (TPSA) 44.10 Ų
XlogP 6.40

Synonyms

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(E)-14-methyl-1-sulfinylpentadec-2-en-1-amine

2D Structure

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2D Structure of Sulfinemycin

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 94.80% 96.09%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 92.98% 97.29%
CHEMBL3060 Q9Y345 Glycine transporter 2 91.54% 99.17%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 90.16% 94.45%
CHEMBL2581 P07339 Cathepsin D 88.99% 98.95%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 88.53% 90.71%
CHEMBL3130 O00329 PI3-kinase p110-delta subunit 86.68% 96.47%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 86.56% 89.34%
CHEMBL3359 P21462 Formyl peptide receptor 1 85.22% 93.56%
CHEMBL2885 P07451 Carbonic anhydrase III 83.28% 87.45%
CHEMBL1937 Q92769 Histone deacetylase 2 82.03% 94.75%
CHEMBL1907 P15144 Aminopeptidase N 81.90% 93.31%
CHEMBL3267 P48736 PI3-kinase p110-gamma subunit 81.75% 95.71%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 81.48% 96.00%
CHEMBL3975 P09467 Fructose-1,6-bisphosphatase 81.26% 92.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 80.97% 91.11%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 80.81% 100.00%
CHEMBL230 P35354 Cyclooxygenase-2 80.39% 89.63%

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 10356621
LOTUS LTS0063530
wikiData Q77310263