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BioLiP

PDB CCD ID: QPH
Number of entries in BioLiP: 0
Chemical formula: C10 H11 N O3
InChI: InChI=1S/C10H11NO3/c12-7-11-9(10(13)14)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,11,12)(H,13,14)/t9-/m0/s1
InChIKey: NSTPXGARCQOSAU-VIFPVBQESA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.2c1ccc(cc1)CC(C(=O)O)NC=O
OpenEye OEToolkits 1.7.2c1ccc(cc1)C[C@@H](C(=O)O)NC=O
CACTVS 3.370OC(=O)[CH](Cc1ccccc1)NC=O
CACTVS 3.370OC(=O)[C@H](Cc1ccccc1)NC=O
ACDLabs 12.01O=C(O)C(NC=O)Cc1ccccc1
Name:N-formyl-L-phenylalanine
ZINC: ZINC000082056149
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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