potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate

C4H8KNO6 — CID 102600774

IUPACpotassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate
SMILESN.O=C([O-])[C@H](O)[C@@H](O)C(=O)O.[K+]
InChIInChI=1S/C4H6O6.K.H3N/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;1H3/q;+1;/p-1/t1-,2-;;/m1../s1
InChIKeySOJZPUFVOCGQIP-OLXYHTOASA-M
MW205.21 g/mol
LogP-6.29
Rot. Bonds3

About potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate

potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate (PubChem CID 102600774) has the molecular formula C4H8KNO6 and a molecular weight of 205.21 g/mol. Its IUPAC name is potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate.

Molecular Properties

Compound Namepotassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate
PubChem CID102600774
Molecular FormulaC4H8KNO6
Molecular Weight205.21 g/mol
Exact Mass205.00
IUPAC Namepotassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate
SMILESN.O=C([O-])[C@H](O)[C@@H](O)C(=O)O.[K+]
InChIInChI=1S/C4H6O6.K.H3N/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;1H3/q;+1;/p-1/t1-,2-;;/m1../s1
InChIKeySOJZPUFVOCGQIP-OLXYHTOASA-M
XLogP-6.29
TPSA152.89 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 5-6.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3R)-2,3,4-trihydroxy-4-oxobutanoate
CID 24755569
chromium(3+);tris(2,3,4-trihydroxy-4-oxobutanoate)
CID 173015328
azanium 2,3,4-trihydroxy-4-oxobutanoate
CID 6432315
CID 6378487
CID 6378487
dipotassium;(2R,3S)-2,3-dihydroxybutanedioate
CID 6452017
methylazanium;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate
CID 139045346
sodium;oxobismuthanylium;bis(2,3,4-trihydroxy-4-oxobutanoate)
CID 158452904
potassium;2,3-dihydroxybutanedioate;zirconium(2+)
CID 19373860
potassium;antimony(3+);bis((2R,3R)-2,3-dihydroxybutanedioate)
CID 90471392
2,3-dihydroxybutanedioate
CID 19608871
azane;(2R,3S)-2,3-dihydroxybutanedioic acid
CID 175972290
tetraaluminum;tris(2,3-dihydroxybutanedioate);oxalate
CID 21451236

Frequently Asked Questions

What is the IUPAC name of potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate?
The IUPAC name of potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate (CID 102600774) is potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate.
What is the SMILES notation for potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate?
The canonical SMILES for potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate is N.O=C([O-])[C@H](O)[C@@H](O)C(=O)O.[K+].
What is the InChIKey of potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate?
The InChIKey is SOJZPUFVOCGQIP-OLXYHTOASA-M. The full InChI is InChI=1S/C4H6O6.K.H3N/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;1H3/q;+1;/p-1/t1-,2-;;/m1../s1.
What are the key properties of potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate?
potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate has a molecular weight of 205.21 g/mol, XLogP of -6.29, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;azane;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate is sourced from PubChem (CID 102600774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).