General
Preferred name
L-??Hydroxybutyric acid
Synonyms
(S)-¦Â-Hydroxybutanoic acid ()
L-¦Â-Hydroxybutyric acid ()
(S)-??Hydroxybutanoic acid ()
(S)-3-Hydroxybutanoic acid ()
(S)-β-Hydroxybutanoic acid ()
L-(+)-3-Hydroxybutyric acid ()
L-β-Hydroxybutyric acid ()
β-L-hydroxybutyric acid ()
(S)-3-Hydroxybutyrate (sodium salt) ()
P&D ID
PD048557
CAS
6168-83-8
127604-16-4
Tags
natural product
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
7
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
46
Properties
(calculated by RDKit )
Molecular Weight
104.05
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.16
TPSA
57.53
Fraction CSP3
0.75
Chiral centers
1.0
Largest ring
0.0
QED
0.51
QED
0.51
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data