Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017698
PROPERTIES
| NPAID | NPA017698 |
|---|---|
| CLUSTER ID | 1952 |
| NODE ID | 1566 |
| NAME | 4,6,4’,6’-Tetrabromo-3,3’-dihydroxy-5,5’-dimethyldiphenyl ether |
| FORMULA | C14H10Br4O3 |
| MOLECULAR WEIGHT (Da) | 545.8470 |
| ACCURATE MASS (Da) | 541.7363 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | chrysogenum |
| InChIKey | IZCKAIWTJWFNEI-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H10Br4O3/c1-5-11(15)7(19)3-9(13(5)17)21-10-4-8(20)12(16)6(2)14(10)18/h3-4,19-20H,1-2H3 |
| SMILES | CC1=C(C(=CC(=C1Br)OC2=C(C(=C(C(=C2)O)Br)C)Br)O)Br |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yang, Guohua; Yun, Keumja; Nenkep, Viviane N.; Choi, Hong Dae; Kang, Jung Sook; Son, Byeng Wha Induced Production of Halogenated Diphenyl Ethers from the Marine-Derived Fungus Penicillium chrysogenum Chemistry and Biodiversity 2010 7 (11) 2766-2770. | ||
|---|---|---|---|
| DOI | 10.1002/cbdv.201000067 | PMID | 21072776 |
