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BioLiP

PDB CCD ID: EOA
Number of entries in BioLiP: 0
Chemical formula: C9 H11 N O
InChI: InChI=1S/C9H11NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,10,11)
InChIKey: NOOOMJZHMKSKBF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341		O=CNCCc1ccccc1
OpenEye OEToolkits 1.5.0c1ccc(cc1)CCNC=O
Name:N-PHENETHYL-FORMAMIDE
ZINC: ZINC000001562004
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)(download the PDF file).
  • 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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