SEQ2FUN

BioLiP

PDB CCD ID: 04G
Number of entries in BioLiP: 3
Chemical formula: C12 H7 N O3
InChI: InChI=1S/C12H7NO3/c14-7-1-3-9-11(5-7)16-12-6-8(15)2-4-10(12)13-9/h1-6,14H
InChIKey: HSSLDCABUXLXKM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370Oc1ccc2N=C3C=CC(=O)C=C3Oc2c1
ACDLabs 12.01O=C2C=CC1=Nc3c(OC1=C2)cc(O)cc3
OpenEye OEToolkits 1.7.2c1cc2c(cc1O)OC3=CC(=O)C=CC3=N2
Name:7-hydroxy-3H-phenoxazin-3-one;
RESORUFIN
ChEMBL: CHEMBL1185321
ZINC: ZINC000004428361
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).