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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

BioLiP

PDB CCD ID: MNW
Number of entries in BioLiP: 1
Chemical formula: C6 H9 O7 V
InChI: InChI=1S/C6H6O3.4H2O.V/c1-4-6(8)5(7)2-3-9-4;;;;;/h2-3H,1H3,(H-,7,8);4*1H2;/q;;;;;+6/p-5
InChIKey: YLEPPWNUQSQYPV-UHFFFAOYSA-I
SMILES:
SoftwareSMILES
CACTVS 3.385Cc1[o+]ccc2O[V](O)(O)(O)(O)Oc12
OpenEye OEToolkits 2.0.7Cc1c2c(cc[o+]1)O[V](O2)(O)(O)(O)O
Name:8,8,8,8-tetrakis($l^{1}-oxidanyl)-2-methyl-3,7,9-trioxa-8$l^{6}-vanadabicyclo[4.3.0]nona-1,5-diene

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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