7-hydroxy-6-methylfuro(3,4-c)pyridin-3(1H)-one

Details

• Internal ID: 4aa3c556-2989-4936-bd55-69d5ebce9ab2
• Taxonomy: Organoheterocyclic compounds > Pyridines and derivatives > Pyridinecarboxylic acids and derivatives > Pyridinecarboxylic acids
• IUPAC Name: 7-hydroxy-6-methyl-1H-furo[3,4-c]pyridin-3-one
• InChI: InChI=1S/C8H7NO3/c1-4-7(10)6-3-12-8(11)5(6)2-9-4/h2,10H,3H2,1H3
• InChI Key: PPAXBSPBIWBREI-UHFFFAOYSA-N
• Popularity: 10 references in papers

Physical and Chemical Properties

• Molecular Formula: C₈H₇NO₃
• Molecular Weight: 165.15 g/mol
• Exact Mass: 165.042593085 g/mol
• Topological Polar Surface Area (TPSA): 59.40 Ų
• XlogP: 0.30

Synonyms

• Pyracin-5
• .alpha.-Pyracin
• 5-Pyridoxic acid lactone
• 4543-56-0
• 7-Hydroxy-6-methylfuro[3,4-c]pyridin-3(1H)-one
• Pyridoxic acid .gamma.-lactone
• Pyridoxic acid, .gamma.-lactone
• 7-hydroxy-6-methyl-1H-furo[3,4-c]pyridin-3-one
• NSC15983
• NSC 15983
• UA6Q3JV3FZ
• CHEBI:2124
• NSC41813
• NSC-15983
• NSC-41813
• 7-hydroxy-6-methyl-1H,3H-furo[3,4-c]pyridin-3-one
• Furo(3,4-c)pyridin-3(1H)-one, 7-hydroxy-6-methyl-
• Furo[3,4-c]pyridin-3(1H)-one, 7-hydroxy-6-methyl-
• 2-METHYL-3-HYDROXY-4-HYDROXYMETHYL-5-CARBOXYPYRIDINE LACTONE
• C06052
• Furo[3, 7-hydroxy-6-methyl-
• {Furo[3,4-c]pyridin-3(1H)-one,} 7-hydroxy-6-methyl-
• 3-Carboxy-4-(hydroxymethyl)-5-hydroxy-6-methylpyridine lactone
• 7-HYDROXY-6-METHYLFURO(3,4-C)PYRIDIN-3(1H)-ONE
• alpha-Pyracin
• a-Pyracin
• 4keq
• UNII-UA6Q3JV3FZ
• 5-Pyridoxic acid g-lactone
• Pyridoxic acid gamma-lactone
• SCHEMBL12444323
• DTXSID80196511
• PPAXBSPBIWBREI-UHFFFAOYSA-N
• AIDS124182
• AIDS-124182
• AKOS006273289
• 5-PYRIDOXIC ACID .GAMMA.-LACTONE
• EN300-370712
• 7-hydroxy-6-methyl-1H-furo[4,3-d]pyridin-3-one
• 7-Hydroxy-6-methylfuro[3,4-c]pyridin-3(1H)-one #
• Q27105557
• 5PN

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL1951	P21397	Monoamine oxidase A	96.56%	91.49%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	93.47%	95.56%
CHEMBL3038477	P67870	Casein kinase II alpha/beta	89.13%	99.23%
CHEMBL2002	P12268	Inosine-5'-monophosphate dehydrogenase 2	89.13%	98.21%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	87.83%	94.00%
CHEMBL5409	Q8TDU6	G-protein coupled bile acid receptor 1	87.53%	93.65%
CHEMBL2581	P07339	Cathepsin D	87.42%	98.95%
CHEMBL1293249	Q13887	Kruppel-like factor 5	86.75%	86.33%
CHEMBL3401	O75469	Pregnane X receptor	86.36%	94.73%
CHEMBL1806	P11388	DNA topoisomerase II alpha	83.82%	89.00%
CHEMBL1293277	O15118	Niemann-Pick C1 protein	83.63%	81.11%
CHEMBL4208	P20618	Proteasome component C5	83.02%	90.00%
CHEMBL4261	Q16665	Hypoxia-inducible factor 1 alpha	82.30%	85.14%
CHEMBL2535	P11166	Glucose transporter	82.00%	98.75%
CHEMBL3880	P07900	Heat shock protein HSP 90-alpha	81.66%	96.21%
CHEMBL5697	Q9GZT9	Egl nine homolog 1	81.08%	93.40%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 78300
• LOTUS: LTS0191955
• wikiData: Q27105557