potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate

C7H9KO10 — CID 158416399

IUPACpotassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate
SMILESO=C(O)O.O=C([O-])CC(O)(CC(=O)O)C(=O)O.[K+]
InChIInChI=1S/C6H8O7.CH2O3.K/c7-3(8)1-6(13,5(11)12)2-4(9)10;2-1(3)4;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);(H2,2,3,4);/q;;+1/p-1
InChIKeyGZYHNIHHRYGVCV-UHFFFAOYSA-M
MW292.24 g/mol
LogP-5.36
Rot. Bonds5

About potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate

potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate (PubChem CID 158416399) has the molecular formula C7H9KO10 and a molecular weight of 292.24 g/mol. Its IUPAC name is potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate.

Molecular Properties

Compound Namepotassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate
PubChem CID158416399
Molecular FormulaC7H9KO10
Molecular Weight292.24 g/mol
Exact Mass291.98
IUPAC Namepotassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate
SMILESO=C(O)O.O=C([O-])CC(O)(CC(=O)O)C(=O)O.[K+]
InChIInChI=1S/C6H8O7.CH2O3.K/c7-3(8)1-6(13,5(11)12)2-4(9)10;2-1(3)4;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);(H2,2,3,4);/q;;+1/p-1
InChIKeyGZYHNIHHRYGVCV-UHFFFAOYSA-M
XLogP-5.36
TPSA192.49 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.24
LogP ≤ 5-5.36
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Analyze potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate 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

diazanium;3-carboxy-3-hydroxypentanedioate;2-hydroxypropane-1,2,3-tricarboxylic acid
CID 158907064
calcium;3-carboxy-3-hydroxypentanedioate;bis(2-hydroxypropane-1,2,3-tricarboxylic acid)
CID 161442924
sodium;3-carboxy-3,5-dihydroxy-5-oxopentanoate;2-hydroxypropane-1,2,3-tricarboxylic acid
CID 23689315
sodium;3-carboxy-3,5-dihydroxy-5-oxopentanoate;2-hydroxypropane-1,2,3-tricarboxylic acid;tetrahydrate
CID 173301811
diazanium;3-carboxy-3,5-dihydroxy-5-oxopentanoate;methanolate
CID 176896152
disodium;carbonic acid;3-carboxy-3-hydroxypentanedioate
CID 173139315
disodium;boric acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate;chloride
CID 159592438
sodium;acetic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate
CID 173271021
3-carboxy-3,5-dihydroxy-5-oxopentanoate;2-hydroxypropane-1,2,3-tricarboxylate;2-hydroxypropane-1,2,3-tricarboxylic acid;titanium(4+)
CID 158572347
trizinc;bis(2-hydroxypropane-1,2,3-tricarboxylate);tris(2-hydroxypropane-1,2,3-tricarboxylic acid)
CID 173326194
magnesium;3-carboxy-3-hydroxypentanedioate;iron(2+);oxygen(2-)
CID 172769330
3-carboxy-3-hydroxypentanedioate;strontium-87(2+)
CID 172866726

Frequently Asked Questions

What is the IUPAC name of potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate?
The IUPAC name of potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate (CID 158416399) is potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate.
What is the SMILES notation for potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate?
The canonical SMILES for potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate is O=C(O)O.O=C([O-])CC(O)(CC(=O)O)C(=O)O.[K+].
What is the InChIKey of potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate?
The InChIKey is GZYHNIHHRYGVCV-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H8O7.CH2O3.K/c7-3(8)1-6(13,5(11)12)2-4(9)10;2-1(3)4;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);(H2,2,3,4);/q;;+1/p-1.
What are the key properties of potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate?
potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate has a molecular weight of 292.24 g/mol, XLogP of -5.36, 5 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;carbonic acid;3-carboxy-3,5-dihydroxy-5-oxopentanoate is sourced from PubChem (CID 158416399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).