N-[2-(2,2-dimethyl-2H-chromen-6-yl)ethyl]-N,3-dimethylbutanamide
AlkaPlorer ID: AK112209
Synonym: None
IUPAC Name: N-[2-(2,2-dimethylchromen-6-yl)ethyl]-N,3-dimethylbutanamide
Structure
SMILES: CC(C)CC(=O)N(C)CCC1=CC=C2OC(C)(C)C=CC2=C1
InChI: InChI=1S/C19H27NO2/c1-14(2)12-18(21)20(5)11-9-15-6-7-17-16(13-15)8-10-19(3,4)22-17/h6-8,10,13-14H,9,11-12H2,1-5H3
InChIKey: AYZROHZPTYWIEK-UHFFFAOYSA-N
Reference
Chromene amides from Amyris texana
PubChem CID: 15693450
LOTUS: LTS0103452
NPASS: NPC283079
COCONUT: CNP0139675
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 301.43
TPSA？: 29.540000000000003
MolLogP？: 3.9178000000000033
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Agrostis stolonifera | Agrostis stolonifera | Activity | nan | None | 10.1021/jf101626g |
| Botrytis cinerea | Botrytis cinerea | GI | 80.0 | % | 10.1021/jf101626g |
| Lactuca sativa | Lactuca sativa | Activity | nan | None | 10.1021/jf101626g |
| Planktothrix perornata | Planktothrix perornata | Activity | 10.0 | uM | 10.1016/j.ejmech.2016.07.057 |
| Planktothrix perornata | Planktothrix perornata | IC50 | 2300.0 | nM | 10.1016/j.ejmech.2016.07.057 |
| Selenastrum capricornutum | Selenastrum capricornutum | Activity | 100.0 | uM | 10.1016/j.ejmech.2016.07.057 |
| Selenastrum capricornutum | Selenastrum capricornutum | IC50 | 12600.0 | nM | 10.1016/j.ejmech.2016.07.057 |