Alternariolmethylether
Alternariolmethylether Structure
Systematic / IUPAC Name: 3,7-Dihydroxy-9-methoxy-1-methyl-6H-benzo[c]chromen-6-one
ID: Reference6178
Other Names:
Djalonensone;
3,7-Dihydroxy-9-methoxy-1-methyl-6H-dibenzo[b,d]pyran-6-one ;
3,7-Dihydroxy-9-methoxy-1-methylbenzo[c]chromen-6-one;
6H-Dibenzo[b,d]pyran-6-one, 3,7-dihydroxy-9-methoxy-1-methyl- ;
Alternariol methyl ether
; more
Formula: C15H12O5
Class: Natural Toxins
Spectral Data
Alternariolmethylether mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Elite; Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 2 |
| No. of Spectra | 487 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | IT; FT |
| Last Modification | 12/16/2016 11:20:17 AM |
Identificators
| InChI | InChI=1S/C15H12O5/c1-7-3-8(16)4-12-13(7)10-5-9(19-2)6-11(17)14(10)15(18)20-12/h3-6,16-17H,1-2H3 |
| InChI Key | LCSDQFNUYFTXMT-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CC(=CC2=C1C3=CC(=CC(=C3C(=O)O2)O)OC)O |
| CAS | 23452053 |
| Splash | |
| Other Names |
Djalonensone; 3,7-Dihydroxy-9-methoxy-1-methyl-6H-dibenzo[b,d]pyran-6-one ; 3,7-Dihydroxy-9-methoxy-1-methylbenzo[c]chromen-6-one; 6H-Dibenzo[b,d]pyran-6-one, 3,7-dihydroxy-9-methoxy-1-methyl- ; Alternariol methyl ether; Alternariol monomethylether; Alternariol-9-methyl ether |
In Other Databases
| ChemSpider | 4514573 |
| ChEMBL | CHEMBL483526 |
| ChemIDPlus | 023452053 |
| PubChem | 5360741 |