Ligand
Ligand Name:   2-KETOBUTYRIC ACID
Ligand Type:   non-polymer
Ligand ID:   COVPDB143 PubChem:   58
Synonym(s):  
  •   2-oxobutanoic acid
  • 2-oxobutyric acid
  • 600-18-0
  • alpha-ketobutyric acid
  • butanoic acid, 2-oxo-
  • 2-oxobutyrate
  • ketobutyrate
  • 3-methylpyruvic acid
  • pyruvic acid, methyl-
  • butyric acid, 2-oxo-
  • formic acid, propionyl-
  • 2-ketobutanoic acid
  • alpha-oxo-n-butyric acid
  • alpha-oxobutyric acid
  • 3-methyl pyruvic acid
  • 2-oxo-n-butyric acid
  • alpha-ketobutyrate
  • 2-oxo-butyrate
  • propionylformic acid
  • 2-oxo-butyric acid
  • 2-oxo-butanoic acid
  • alpha-ketobutric acid
  • 2-keto-butyrate
  • alpha-keto-n-butyric acid
  • unii-b92rb6hy1a
  • fema no. 3723
  • 2-ketobutanoate
  • .alpha.-ketobutric acid
  • .alpha.-oxobutyric acid
  • .alpha.-ketobutyric acid
  • nsc 60533
  • .alpha.-oxo-n-butyric acid
  • b92rb6hy1a
  • butyric acid, 2-oxo- (8ci)
  • chebi:30831
  • butanoic acid, 2-oxo- (9ci)
  • mfcd00004164
  • a-ketobutyric acid
  • 2kt
  • oxobutyric acid
  • a-ketobutyrate
  • a-oxobutyrate
  • propionyl-formate
  • 3-methylpyruvate
  • 2-oxo-butanoate
  • a-oxobutyric acid
  • a-oxo-n-butyrate
  • a-keto-n-butyrate
  • 2-oxo-n-butyrate
  • methyl pyruvic acid
  • methyl-pyruvic acid
  • einecs 209-986-9
  • .alpha.-oxobutyrate
  • 2-keto-butyric acid
  • propionyl-formic acid
  • alpha-oxo-n-butyrate
  • alpha-keto-n-butyrate
  • a-oxo-n-butyric acid
  • alpha-oxobutanoic acid
  • a-keto-n-butyric acid
  • 2-oxobutanoic acid #
  • 4b5t
  • acmc-1aw4c
  • bmse000325
  • 2-ketobutyric acid, 97%
  • schembl24128
  • .alpha.-keto-n-butyric acid
  • chembl171246
  • dtxsid9060524
  • 2-oxobutyric acid, >=95%, fg
  • nsc60533
  • zinc1532540
  • anw-33412
  • co0049
  • lmfa01060002
  • nsc-60533
  • s6329
  • akos005207091
  • 2-oxobutyric acid, analytical standard
  • am90224
  • cs-w007926
  • db04553
  • hy-w007926
  • ls41883
  • mcule-8360398438
  • ak-48379
  • ds-14641
  • sy011034
  • db-000166
  • 2-oxobutyric acid, purum, >=97.0% (t)
  • ft-0612731
  • o0364
  • x3296
  • c00109
  • q209457
  • 35db7b81-3f44-4d6f-9e8b-c0f8b751d3ad
show 95 synonym(s)
DrugBank:   DB04553 ChEMBL:   CHEMBL171246
Canonical SMILES:   CCC(=O)C(O)=O
Standard InChI:   InChI=1S/C4H6O3/c1-2-3(5)4(6)7/h2H2,1H3,(H,6,7)
Molecular Formula:   C4H6O3 Mol. Weight:   102.03169 logP:   0.0501
HBD:   1 HBA:   2
#Rotatable Bonds:   2 TPSA:   54.37

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
4-hydroxy-tetrahydrodipicolinate synthase D0CFC3 (D0CFC3_ACIB2) Acinetobacter baumannii (strain ATCC 19606 / DSM 30007 / CIP 70.34 / JCM 6841 / NBRC 109757 / NCIMB 12457 / NCTC 12156 / 81) 3TDF 2KT
-
-
SHOW