MHV
4-OXO-L-PIPECOLIC ACID
Created: | 2010-07-15 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 19 |
Chiral Atom Count | 1 |
Bond Count | 19 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 4-OXO-L-PIPECOLIC ACID |
Systematic Name (OpenEye OEToolkits) | (2S)-4-oxopiperidine-2-carboxylic acid |
Formula | C6 H9 N O3 |
Molecular Weight | 143.141 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C1NCCC(=O)C1 |
SMILES | CACTVS | 3.352 | OC(=O)[CH]1CC(=O)CCN1 |
SMILES | OpenEye OEToolkits | 1.6.1 | C1CNC(CC1=O)C(=O)O |
Canonical SMILES | CACTVS | 3.352 | OC(=O)[C@@H]1CC(=O)CCN1 |
Canonical SMILES | OpenEye OEToolkits | 1.6.1 | C1CN[C@@H](CC1=O)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C6H9NO3/c8-4-1-2-7-5(3-4)6(9)10/h5,7H,1-3H2,(H,9,10)/t5-/m0/s1 |
InChIKey | InChI | 1.03 | UAISREBYDOFHJY-YFKPBYRVSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 11062499, 26183538 |