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(S)-azetidine-2-carboxylic acid

AlkaPlorer ID: AK018353

Synonym: 'Azetidine-2-carboxylic acid', '(S)-(-)-Azetidine-2-carboxylic acid', '2133-34-8', 'Azetidyl-2-carboxylic acid', 'L-Azetidine 2-carboxylic acid', '(S)-2-azetidinecarboxylic acid', '(2S)-2-Azetidinecarboxylic acid', '2517-04-6', '(S)-azetidine-2-carboxylic acid'

IUPAC Name: (2S)-azetidine-2-carboxylic acid

Structure

SMILES: O=C(O)[C@@H]1CCN1

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InChI: InChI=1S/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m0/s1

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InChIKey: IADUEWIQBXOCDZ-VKHMYHEASA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Delonix regia Delonix Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 101.10500000000002

TPSA？: 49.33

MolLogP？: -0.5671000000000002

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Bloom syndrome protein Potency 1000.0 nM None
Homo sapiens Prelamin-A/C Potency 5623.4 nM None
Homo sapiens Proton-coupled amino acid transporter 1 Ki 1800000.0 nM 10.1016/j.bmc.2011.08.058
Homo sapiens Proton-coupled amino acid transporter 1 pKi -0.26 mM 10.1016/j.bmc.2011.08.058
Rattus norvegicus Amino acid transporter Inhibition 25.0 % None
None Cerebellar granule neurone Influx 16.0 nM mg-1 10.1021/jm00168a007
None Cerebellar granule neurone Influx 44.5 nM mg-1 10.1021/jm00168a007
None Cerebellar granule neurone Stimulation 105.0 % 10.1021/jm00168a007
None Unchecked IC50 706000.0 nM 10.1016/j.ejmech.2010.02.029
None Unchecked IC50 1950000.0 nM 10.1016/j.ejmech.2010.02.029
None Unchecked Inhibition nan % 10.1038/nchembio873

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT004453 CC(=O)[32S].O=C(O)[C@@H]1CCN1>>CC(=O)N1CCC1C(=O)O None
AKRT004454 CC(=O)[32S].O=C(O)[C@@H]1CCN1>>CC(=O)N1CC[C@H]1C(=O)O None
AKRT004752 CC(=O)[CoA].O=C(O)[C@@H]1CCN1>>CC(=O)N1CCC1C(=O)O enzymemap_30375
AKRT004753 CC(=O)[CoA].O=C(O)[C@@H]1CCN1>>CC(=O)N1CC[C@H]1C(=O)O RXN-19375
AKRT012930 C[C@@H](O)[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@@H]1CCN1>>C[C@@H](O)[C@H](NC(=O)[C@@H]1CCN1)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O None
AKRT012941 C[C@@H](O)[C@H](N)C(=O)O.O=C(O)[C@@H]1CCN1>>C[C@@H](O)[C@H](NC(=O)[C@@H]1CCN1)C(=O)O enzymemap_90785
AKRT023035 O=C(O)[C@@H]1CCN1>>NCCC(O)C(=O)O RXN-19327
AKRT023036 O=C(O)[C@@H]1CCN1>>O=C(O)[C@H]1CCN1 enzymemap_87006
AKRT023037 O=C(O)[C@@H]1CCN1>>O=C(O)[C@H]1NC[C@H]1O enzymemap_10773