4-Hydroxy-3-pyridinecarboxylic acid; NH-form, N-Me, nitrile
AlkaPlorer ID: AK209329
Synonym: 1,4-Dihydro-1-methyl-4-oxo-3-pyridinecarbonitrile, 3-Cyano-1-methyl-4(1H)-pyridinone, Mallorepine
IUPAC Name: 1-methyl-4-oxopyridine-3-carbonitrile
Structure
SMILES: CN1C=CC(=O)C(C#N)=C1
InChI: InChI=1S/C7H6N2O/c1-9-3-2-7(10)6(4-8)5-9/h2-3,5H,1H3
InChIKey: VVNHMAOQCMDJHT-UHFFFAOYSA-N
Reference
Mallorepine, Cyano–γ–Pyridone from Mallotus repandus
PubChem CID: 13027
CAS: 767-98-6
LOTUS: LTS0070323
SuperNatural Ⅲ: SN0401255
COCONUT: CNP0196141
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mallotus repandus | Mallotus | Euphorbiaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 134.138
TPSA？: 45.79
MolLogP？: 0.25698
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|