Showing entry for xi-3-Hydroxy-5-phenylpentanoic acid O-beta-D-Glucopyranoside


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0004322
Compound Namexi-3-Hydroxy-5-phenylpentanoic acid O-beta-D-Glucopyranoside
Structure
FormulaC17H24O8
InchiKeyHRYIDVZLDQBLFF-UHFFFAOYSA-N
SMILESOCC1OC(OC(CCC2=CC=CC=C2)CC(O)=O)C(O)C(O)C1O
InchiInChI=1S/C17H24O8/c18-9-12-14(21)15(22)16(23)17(25-12)24-11(8-13(19)20)7-6-10-4-2-1-3-5-10/h1-5,11-12,14-18,21-23H,6-9H2,(H,19,20)
IUPAC5-phenyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentanoic acid
Molecular Weight356.37
Pubchem Id16681750
Chembl IdCHEMBL1407474
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Binding DB 50578
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT012942 Induced myeloid leukemia cell differentiation protein Mcl-1 reviewed Signaling MCL1 - 1606.105247 - -
reviewed BXGT013529 Eukaryotic translation initiation factor 4H reviewed Nucleic acid binding EIF4H - 23645 - -
reviewed BXGT007762 Polyadenylate-binding protein 1 reviewed PABPC1 - 69430 - -
reviewed BXGT008148 Intestinal-type alkaline phosphatase 1 reviewed Alpi - - - 33700
reviewed BXGT006942 Intestinal-type alkaline phosphatase reviewed Enzyme ALPI - - - 59200
reviewed BXGT007603 Alkaline phosphatase, germ cell type reviewed Enzyme ALPG - - - 73000
reviewed BXGT006338 Alkaline phosphatase, tissue-nonspecific isozyme reviewed Enzyme ALPL - - - 57600
reviewed BXGT005570 Tyrosine-protein kinase ABL1 reviewed Kinase ABL1 - 50230 - -
reviewed BXGT005956 Serum albumin reviewed ALB - >94115 - -
reviewed BXGT005130 PC4 and SFRS1-interacting protein reviewed Signaling PSIP1 - 869.51 - -
reviewed BXGT005130 PC4 and SFRS1-interacting protein reviewed Signaling PSIP1 - 619.99 - -
CHEMBL CHEMBL1407474
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 25118 nM
P54132 BXGT011032 Bloom syndrome protein reviewed - BLM Potency - 1523 nM
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 89125 nM
P46063 BXGT010501 ATP-dependent DNA helicase Q1 reviewed Enzyme RECQL Potency '=' 3548 nM
P03070 BXGT006016 Large T antigen reviewed - IC50 - 57570 nM
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 39810 nM
Q4GZG4 BXGT014813 Phosphoglycerate kinase unreviewed - PGKC Potency - 1031 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 7943 nM
P05186 BXGT006338 Alkaline phosphatase, tissue-nonspecific isozyme reviewed Enzyme ALPL EC50 '=' 57600 nM
Q07820 BXGT012942 Induced myeloid leukemia cell differentiation protein Mcl-1 reviewed Signaling MCL1 IC50 '=' 1606 nM
P55212 BXGT011112 Caspase-6 reviewed Enzyme CASP6 AC50 '=' 283 nM
P10696 BXGT007603 Alkaline phosphatase, germ cell type reviewed Enzyme ALPG EC50 '=' 73000 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 2909 nM
P37840 BXGT010015 Alpha-synuclein reviewed Transporter SNCA Potency - 5623 nM
P09923 BXGT006942 Intestinal-type alkaline phosphatase reviewed Enzyme ALPI EC50 '=' 59200 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 26854 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 25118 nM
P51570 BXGT010858 Galactokinase reviewed Kinase GALK1 Potency '=' 53036 nM
Q13671 BXGT013391 Ras and Rab interactor 1 reviewed Enzyme modulator RIN1 IC50 '=' 50230 nM
P00519 BXGT005570 Tyrosine-protein kinase ABL1 reviewed Kinase ABL1 IC50 '=' 50230 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 354 nM
P55210 BXGT011110 Caspase-7 reviewed Enzyme CASP7 AC50 '=' 30930 nM
P06746 BXGT006496 DNA polymerase beta reviewed Enzyme POLB Potency '=' 707 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 1995 nM
Q14191 BXGT013452 Werner syndrome ATP-dependent helicase reviewed Enzyme WRN Potency - 8912 nM
P07378 BXGT006616 Phosphoglycerate kinase, glycosomal reviewed - Potency - 3548 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 8912 nM
Q9UIF8 BXGT021718 Bromodomain adjacent to zinc finger domain protein 2B reviewed - BAZ2B Potency - 50118 nM
Q962Y6 BXGT019597 Thioredoxin glutathione reductase unreviewed - TGR Potency '=' 31622 nM
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA Potency '=' 39810 nM
P24822 BXGT008996 Intestinal-type alkaline phosphatase reviewed - Iap EC50 - 33700 nM
O95149 BXGT005350 Snurportin-1 reviewed - SNUPN Potency - 2818 nM
Q14974 BXGT013516 Importin subunit beta-1 reviewed Transporter KPNB1 Potency - 2818 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 794 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 8912 nM
Q14191 BXGT013452 Werner syndrome ATP-dependent helicase reviewed Enzyme WRN Potency - 1709 nM
O15648 BXGT004185 ATP-dependent 6-phosphofructokinase reviewed - pfk Potency - 26854 nM
P11940 BXGT007762 Polyadenylate-binding protein 1 reviewed - PABPC1 IC50 '=' 69430 nM
Q15056 BXGT013529 Eukaryotic translation initiation factor 4H reviewed Nucleic acid binding EIF4H IC50 '=' 23645 nM
O95398 BXGT005378 Rap guanine nucleotide exchange factor 3 reviewed Enzyme modulator RAPGEF3 Potency - 39810 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 28183 nM
P02769 BXGT005956 Serum albumin reviewed - ALB IC50 '>' 94115 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 10691 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 2667 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 1778 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 1995 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00816 Fats and oils Fats and oils
BXGF00818 Herbs and Spices Herbs and Spices
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease