Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019131
PROPERTIES
| NPAID | NPA019131 |
|---|---|
| CLUSTER ID | 672 |
| NODE ID | 7 |
| NAME | Dihydro-O-Methylsterigmatocystin |
| FORMULA | C19H16O6 |
| MOLECULAR WEIGHT (Da) | 340.3310 |
| ACCURATE MASS (Da) | 340.0947 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | flavus |
| InChIKey | WSBZDTWHZJNGKQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C19H16O6/c1-21-10-4-3-5-11-15(10)17(20)16-12(22-2)8-13-14(18(16)24-11)9-6-7-23-19(9)25-13/h3-5,8-9,19H,6-7H2,1-2H3 |
| SMILES | COC1=CC=CC2=C1C(=O)C3=C(C=C4C(=C3O2)C5CCOC5O4)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cole, RJ; Kirksey, JW; Schroeder, HW Dihydro-O-methylsterigmatocystin, a new metabolite from Aspergillus flavus Tetrahedron Letters 1970 11 (35) 3109-3112. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(01)98427-8 | PMID | - |
