FPK
1-formyl-L-proline
Created: | 2012-10-08 |
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 | 1-formyl-L-proline |
Systematic Name (OpenEye OEToolkits) | (2S)-1-methanoylpyrrolidine-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 | 12.01 | O=CN1C(C(=O)O)CCC1 |
SMILES | CACTVS | 3.385 | OC(=O)[CH]1CCCN1C=O |
SMILES | OpenEye OEToolkits | 1.9.2 | C1CC(N(C1)C=O)C(=O)O |
Canonical SMILES | CACTVS | 3.385 | OC(=O)[C@@H]1CCCN1C=O |
Canonical SMILES | OpenEye OEToolkits | 1.9.2 | C1C[C@H](N(C1)C=O)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C6H9NO3/c8-4-7-3-1-2-5(7)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m0/s1 |
InChIKey | InChI | 1.03 | DHDRGOURKDLAOT-YFKPBYRVSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 12461843 |