SEQ2FUN

BioLiP

PDB CCD ID: MRI
Number of entries in BioLiP: 7
Chemical formula: C15 H10 O7
InChI: InChI=1S/C15H10O7/c16-6-1-2-8(9(18)3-6)15-14(21)13(20)12-10(19)4-7(17)5-11(12)22-15/h1-5,16-19,21H
InChIKey: YXOLAZRVSSWPPT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2c1cc(c(cc1O)O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
CACTVS 3.385Oc1ccc(c(O)c1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
Name:2-[2,4-bis(oxidanyl)phenyl]-3,5,7-tris(oxidanyl)chromen-4-one;
Morin
ChEMBL: CHEMBL28626
DrugBank: DB16770
ZINC: ZINC000003881558
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).