Vertilecanine A; (R)-form, 7-Ketone, glycine amide, Me ester
AlkaPlorer ID: AK102762
Synonym: Vertilecanine C
IUPAC Name: methyl 2-[(5-benzoylpyridine-2-carbonyl)amino]acetate
Structure
SMILES: COC(=O)CNC(=O)C1=CC=C(C(=O)C2=CC=CC=C2)C=N1
InChI: InChI=1S/C16H14N2O4/c1-22-14(19)10-18-16(21)13-8-7-12(9-17-13)15(20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,21)
InChIKey: UPLYPPTXIATHCS-UHFFFAOYSA-N
Reference
Vertilecanins: New Phenopicolinic Acid Analogues from <i>Verticillium</i> <i>l</i><i>ecanii</i>
PubChem CID: 10542078
CAS: 328079-25-0
LOTUS: LTS0175838
NPASS: NPC171648
COCONUT: CNP0121447
{NPAtlas: NPA011984
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Verticillium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 298.298
TPSA？: 85.36
MolLogP？: 1.2153999999999998
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Helicoverpa zea | Helicoverpa zea | Activity | None | None | 10.1021/np000094q |