Cyclo(2-hydroxy-Pro-R-Leu)

Details

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Internal ID f7d7a98d-14e7-403e-9fa1-f66700a61841
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives
IUPAC Name (3R)-8a-hydroxy-3-(2-methylpropyl)-3,6,7,8-tetrahydro-2H-pyrrolo[1,2-a]pyrazine-1,4-dione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C11H18N2O3/c1-7(2)6-8-9(14)13-5-3-4-11(13,16)10(15)12-8/h7-8,16H,3-6H2,1-2H3,(H,12,15)/t8-,11?/m1/s1
InChI Key YSKHAOVIZXUPFR-RZZZFEHKSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C11H18N2O3
Molecular Weight 226.27 g/mol
Exact Mass 226.13174244 g/mol
Topological Polar Surface Area (TPSA) 69.60 Ų
XlogP 0.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Cyclo(2-hydroxy-Pro-R-Leu)

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
CHEMBL253 P34972 Cannabinoid CB2 receptor 99.11% 97.25%
CHEMBL2581 P07339 Cathepsin D 98.41% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.98% 96.09%
CHEMBL1937 Q92769 Histone deacetylase 2 94.10% 94.75%
CHEMBL4026 P40763 Signal transducer and activator of transcription 3 91.53% 82.69%
CHEMBL5103 Q969S8 Histone deacetylase 10 90.72% 90.08%
CHEMBL2781 P19634 Sodium/hydrogen exchanger 1 90.42% 90.24%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 89.49% 90.71%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 88.32% 85.14%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.28% 95.56%
CHEMBL3137262 O60341 LSD1/CoREST complex 87.90% 97.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 85.73% 91.11%
CHEMBL238 Q01959 Dopamine transporter 85.60% 95.88%
CHEMBL5469 Q14289 Protein tyrosine kinase 2 beta 84.92% 91.03%
CHEMBL255 P29275 Adenosine A2b receptor 84.68% 98.59%
CHEMBL3310 Q96DB2 Histone deacetylase 11 84.52% 88.56%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 83.23% 93.03%
CHEMBL218 P21554 Cannabinoid CB1 receptor 82.54% 96.61%
CHEMBL222 P23975 Norepinephrine transporter 81.46% 96.06%
CHEMBL4588 P22894 Matrix metalloproteinase 8 81.34% 94.66%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 81.30% 94.45%
CHEMBL4208 P20618 Proteasome component C5 81.17% 90.00%

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.
There are no matching plants.

Cross-Links

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PubChem 56953620
LOTUS LTS0210670
wikiData Q77520990