(8R)-8-hydroxy-2,5,6,7-tetrahydro-1H-pyrrolizin-3-one

Details

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Internal ID cace6632-fea6-441b-9cd8-efe291f912d4
Taxonomy Organoheterocyclic compounds > Pyrrolizidines > Pyrrolizidinones
IUPAC Name (8R)-8-hydroxy-2,5,6,7-tetrahydro-1H-pyrrolizin-3-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C7H11NO2/c9-6-2-4-7(10)3-1-5-8(6)7/h10H,1-5H2/t7-/m1/s1
InChI Key DKMSCRGCFRXPEL-SSDOTTSWSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C7H11NO2
Molecular Weight 141.17 g/mol
Exact Mass 141.078978594 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP -0.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (8R)-8-hydroxy-2,5,6,7-tetrahydro-1H-pyrrolizin-3-one

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 90.32% 89.63%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.05% 95.56%
CHEMBL2581 P07339 Cathepsin D 86.55% 98.95%
CHEMBL3351 Q13085 Acetyl-CoA carboxylase 1 84.74% 93.04%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 83.92% 93.40%
CHEMBL3012 Q13946 Phosphodiesterase 7A 82.84% 99.29%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 81.51% 93.03%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 81.47% 94.45%

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 13546480
LOTUS LTS0028791
wikiData Q104983470