Coixol
AlkaPlorer ID: AK007864
Synonym: None
IUPAC Name: 6-methoxy-3H-1,3-benzoxazol-2-one
Structure
SMILES: COC1=CC=C2N=C(O)OC2=C1
InChI: InChI=1S/C8H7NO3/c1-11-5-2-3-6-7(4-5)12-8(10)9-6/h2-4H,1H3,(H,9,10)
InChIKey: MKMCJLMBVKHUMS-UHFFFAOYSA-N
Reference
Accumulation and metabolism of the spermine alkaloid aphelandrine in roots of Aphelandra tetragona
PubChem CID: 10772
CAS: 532-91-2
LOTUS: LTS0151051
COCONUT: CNP0215384
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zea mays | Zea | Poaceae | Poales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 165.148
TPSA？: 55.49
MolLogP？: 1.5419999999999998
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | NUGC-4 | Activity | nan | None | 10.1021/np020356j |
| Mus musculus | Mast cell | ID50 | 1.0 | 10'-3M | 10.1021/np50055a009 |
| Mus musculus | Mast cell | Inhibition | 40.0 | % | 10.1021/np50055a009 |
| Mus musculus | Mast cell | Inhibition | 47.3 | % | 10.1021/np50055a009 |
| Sitobion avenae | Sitobion avenae | Activity | 0.0 | None | 10.1021/jf0509005 |
| Sitobion avenae | Sitobion avenae | Activity | 0.00048 | None | 10.1021/jf0509005 |
| Sitobion avenae | Sitobion avenae | Activity | 0.00075 | None | 10.1021/jf0509005 |
| Sitobion avenae | Sitobion avenae | Activity | 0.00139 | None | 10.1021/jf0509005 |
| Sitobion avenae | Sitobion avenae | Activity | 0.0015 | None | 10.1021/jf0509005 |
| Sitobion avenae | Sitobion avenae | Activity | 0.00296 | None | 10.1021/jf0509005 |
| None | NON-PROTEIN TARGET | Activity | 90.0 | % | 10.1016/j.bmc.2009.09.016 |
| None | NON-PROTEIN TARGET | Activity | nan | None | 10.1016/j.bmc.2009.09.016 |
| None | NON-PROTEIN TARGET | Activity | nan | None | 10.1021/np020356j |
| None | Unchecked | Activity | nan | None | 10.1016/j.bmc.2009.09.016 |
| None | Unchecked | Ratio | 1.5 | None | 10.1016/j.bmc.2009.09.016 |