SEQ2FUN

BioLiP

PDB CCD ID: PRI
Number of entries in BioLiP: 4
Chemical formula: C5 H9 N O
InChI: InChI=1S/C5H9NO/c7-4-5-2-1-3-6-5/h4-6H,1-3H2/t5-/m0/s1
InChIKey: JIDDDPVQQUHACU-YFKPBYRVSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1CC(NC1)C=O
CACTVS 3.341O=C[CH]1CCCN1
OpenEye OEToolkits 1.5.0C1C[C@H](NC1)C=O
ACDLabs 10.04O=CC1NCCC1
CACTVS 3.341O=C[C@@H]1CCCN1
Name:PYRROLIDINE-2-CARBALDEHYDE;
PROLINOL
ZINC: ZINC000005849612
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).