Ligand
Ligand Name:   6-formyl pterin
Ligand Type:   non-polymer
Ligand ID:   COVPDB308 PubChem:   135409352
Synonym(s):  
  •   6-formylpterin
  • 712-30-1
  • pterin-6-aldehyde
  • 2-amino-4-hydroxy-6-formylpteridine
  • chebi:70981
  • 2-amino-4-oxo-3,4-dihydropteridine-6-carbaldehyde
  • 2-amino-6-formylpteridin-4-one
  • 2-amino-4-hydroxypteridine-6-carboxaldehyde
  • 2-amino-3,4-dihydro-4-oxo-6-pteridinecarboxaldehyde
  • 6-pteridinecarboxaldehyde,2-amino-3,4-dihydro-4-oxo-
  • 2-amino-4-hydroxy-6-pteridylcarboxaldehyde
  • 2-amino-4-hydroxy-6-pteridinecarboxaldehyde
  • chembl3314206
  • 2-amino-1,4-dihydro-4-oxo-6-pteridinecarboxaldehyde
  • 2-amino-3,4-dihydro-4-oxopteridine-6-carboxaldehyde
  • folic acid impurity 5
  • 2-amino-4-oxo-1h-pteridine-6-carbaldehyde
  • epitope id:178098
  • oprea1_253099
  • schembl398501
  • dtxsid20221396
  • bcp31588
  • 2-amino-4-hydroxy-6-formylpteridin
  • bdbm50497925
  • sbb091247
  • zinc13525580
  • akos000276932
  • 2-amino-4-hydroxypteridine-6-carbaldehyde
  • cs-0064810
  • ft-0661826
  • 2-amino-4-hydroxy-pteridine-6-carbaldehyde
  • 2-amino-4-oxo-1,4-dihydropteridine-6-carbaldehyde
  • 2-amino-4-oxo-4,8-dihydropteridine-6-carbaldehyde
  • q27139229
  • 6-pteridinecarboxaldehyde, 2-amino-3,4-dihydro-4-oxo-
  • 6-formylpterin;pterin-6-aldehyde; 2-amino-4-hydroxy-6-formylpteridine
show 35 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL3314206
Canonical SMILES:   Nc(n1)[nH]c(=O)c(c12)nc(cn2)C=O
Standard InChI:   InChI=1S/C7H5N5O2/c8-7-11-5-4(6(14)12-7)10-3(2-13)1-9-5/h1-2H,(H3,8,9,11,12,14)
Molecular Formula:   C7H5N5O2 Mol. Weight:   191.04433 logP:   -0.8922
HBD:   2 HBA:   6
#Rotatable Bonds:   1 TPSA:   114.62

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Major histocompatibility complex class I-related gene protein Q95460 (HMR1_HUMAN) Homo sapiens (Human) 4L4T 6FP
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