YCP
(2S)-piperidine-2-carboxylic acid
Created: | 2010-01-07 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 1 |
Bond Count | 20 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2S)-piperidine-2-carboxylic acid |
Systematic Name (OpenEye OEToolkits) | (2S)-piperidine-2-carboxylic acid |
Formula | C6 H11 N O2 |
Molecular Weight | 129.157 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.352 | OC(=O)[CH]1CCCCN1 |
SMILES | OpenEye OEToolkits | 1.7.0 | C1CCNC(C1)C(=O)O |
Canonical SMILES | CACTVS | 3.352 | OC(=O)[C@@H]1CCCCN1 |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | C1CCN[C@@H](C1)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1 |
InChIKey | InChI | 1.03 | HXEACLLIILLPRG-YFKPBYRVSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 6931663, 439227 |
ChEMBL | CHEMBL322883 |
ChEBI | CHEBI:30913, CHEBI:61185 |
CCDC/CSD | UBUFAB, WAHDUF, TUQVIN, PAMCAH, ETOPAG |