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BioLiP

PDB CCD ID: ES8
Number of entries in BioLiP: 2
Chemical formula: C15 H11 N O3
InChI: InChI=1S/C15H11NO3/c17-14(18)9-19-16-15-12-7-3-1-5-10(12)11-6-2-4-8-13(11)15/h1-8H,9H2,(H,17,18)
InChIKey: PLACMAVVPYGZGF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01O=C(O)CO\N=C3/c1ccccc1c2c3cccc2
CACTVS 3.385OC(=O)CON=C1c2ccccc2c3ccccc13
OpenEye OEToolkits 1.9.2c1ccc2c(c1)-c3ccccc3C2=NOCC(=O)O
Name:[(9H-fluoren-9-ylideneamino)oxy]acetic acid
ZINC: ZINC000006509238
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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