Hexahomomethionine

Details

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Internal ID 0b36d1fc-e534-4961-981d-0b0b4a8979d3
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids
IUPAC Name 2-amino-10-methylsulfanyldecanoic acid
SMILES (Canonical) CSCCCCCCCCC(C(=O)O)N
SMILES (Isomeric) CSCCCCCCCCC(C(=O)O)N
InChI InChI=1S/C11H23NO2S/c1-15-9-7-5-3-2-4-6-8-10(12)11(13)14/h10H,2-9,12H2,1H3,(H,13,14)
InChI Key XVGBKWQWYRNGDG-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C11H23NO2S
Molecular Weight 233.37 g/mol
Exact Mass 233.14495015 g/mol
Topological Polar Surface Area (TPSA) 88.60 Ų
XlogP 0.40

Synonyms

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2-amino-10-(methylsulfanyl)decanoic acid
SCHEMBL1061716
CHEBI:50714
2-amino-10-methylsulfanyldecanoic acid
Q27122203

2D Structure

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2D Structure of Hexahomomethionine

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 97.54% 96.09%
CHEMBL4040 P28482 MAP kinase ERK2 97.34% 83.82%
CHEMBL3060 Q9Y345 Glycine transporter 2 93.19% 99.17%
CHEMBL3976 Q9UHL4 Dipeptidyl peptidase II 90.89% 92.29%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 90.24% 96.95%
CHEMBL2581 P07339 Cathepsin D 89.12% 98.95%
CHEMBL3359 P21462 Formyl peptide receptor 1 86.59% 93.56%
CHEMBL236 P41143 Delta opioid receptor 83.36% 99.35%
CHEMBL1795117 Q8TEK3 Histone-lysine N-methyltransferase, H3 lysine-79 specific 82.88% 93.56%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 82.19% 90.71%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 81.58% 97.29%
CHEMBL2514 O95665 Neurotensin receptor 2 80.55% 100.00%
CHEMBL1907 P15144 Aminopeptidase N 80.34% 93.31%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 80.20% 100.00%

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.
Arabidopsis thaliana

Cross-Links

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PubChem 25010766
LOTUS LTS0176438
wikiData Q27122203