CC(C(C(=O)O)N)O
CAS: 632-20-2
Name: (2R,3S)-2-amino-3-hydroxybutanoic acid
SMILES: CC(C(C(=O)O)N)O

Molecular Processing

Molecular formula
C4H9NO3
Molecular weight
119.12
Exact mass
119.0582
XLogP
-1.22
TPSA
83.55
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
27.29

Supplementary Information

InChIKey: AYFVYJQAPQTCCC-STHAYSLISA-N
Synonyme
D-threonine632-20-2(2R,3S)-2-amino-3-hydroxybutanoic acid(R)-ThreonineThreonine, D-D-ThreoninD-2-Amino-3-hydroxybutyric acidSG6FYY47DDEINECS 211-171-8NSC 46702BRN 1721643CHEBI:16398DTXSID708590874-04-00-03171 (Beilstein Handbook Reference)NSC-46702(R)ThreonineThreonine, DRefChem:585113DTXCID801323023211-171-8H-D-Thr-OHD-(+)-ThreonineMFCD0006426980-68-2D-thrM02969(2R,3S)-2-Amino-3-hydroxybutyric acidDL-2-Amino-3-hydroxybutyric acid(2R,3S)-2-amino-3-hydroxy-butanoic acid(2R,3S)-2-Amino-3-hydroxybutanoic Acid; (2R,3S)-3-Hydroxy-2-aminobutanoic Acid; (R)-Threonine; NSC 46702
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