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BioLiP

PDB CCD ID: E6T
Number of entries in BioLiP: 1
Chemical formula: C16 H10 N2 O2
InChI: InChI=1S/C16H10N2O2/c19-11-3-1-2-9(6-11)13-8-17-15-12(13)5-4-10-7-18-16(20)14(10)15/h1-8,17,19H
InChIKey: NIESWLNGCVKLAW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc(cc(c1)O)c2c[nH]c3c2ccc4c3C(=O)N=C4
CACTVS 3.385Oc1cccc(c1)c2c[nH]c3c2ccc4C=NC(=O)c34
Name:3-(3-hydroxyphenyl)-1~{H}-pyrrolo[3,4-g]indol-8-one
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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