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- ChemComp-FPK: 1-formyl-L-proline -

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Basic information

EntryDatabase: PDB chemical components / ID: FPK
NameName: 1-formyl-L-proline

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Chemical information

Composition
Formula: C6H9NO3 / Number of atoms: 19 / Formula weight: 143.141 / Formal charge: 0
Others

4bds

PRO

Type: L-PEPTIDE LINKING / PDB classification: ATOMP / One letter code: P / Three letter code: FPK / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4BDS / Parent comp.: PRO
History
Create componentOct 8, 2012
Initial releaseMay 29, 2013
Modify descriptorSep 5, 2014
Modify one letter codeMay 7, 2019
Modify backboneNov 3, 2023
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 12.01O=CN1C(C(=O)O)CCC1
CACTVS 3.385OC(=O)[CH]1CCCN1C=O
OpenEye OEToolkits 1.9.2C1CC(N(C1)C=O)C(=O)O

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SMILES CANONICAL

CACTVS 3.385OC(=O)[C@@H]1CCCN1C=O
OpenEye OEToolkits 1.9.2C1C[C@H](N(C1)C=O)C(=O)O

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InChI

InChI 1.03InChI=1S/C6H9NO3/c8-4-7-3-1-2-5(7)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m0/s1

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InChIKey

InChI 1.03DHDRGOURKDLAOT-YFKPBYRVSA-N

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SYSTEMATIC NAME

ACDLabs 12.011-formyl-L-proline
OpenEye OEToolkits 1.9.2(2S)-1-methanoylpyrrolidine-2-carboxylic acid

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PDB entries

Showing all 3 items

PDB-4bds:
Human butyrylcholinesterase in complex with tacrine

PDB-6xp0:
Structure of human PYCR1 complexed with N-formyl L-proline

PDB-8vre:
Structure of PYCR1 complexed with NADH and N-formyl-L-proline

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