Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005545
PROPERTIES
| NPAID | NPA005545 |
|---|---|
| CLUSTER ID | 2708 |
| NODE ID | 542 |
| NAME | Herqueidiketal |
| FORMULA | C19H20O8 |
| MOLECULAR WEIGHT (Da) | 376.3610 |
| ACCURATE MASS (Da) | 376.1158 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | sp. |
| InChIKey | RFLUIIWXOBEDGV-QNTVGQKLSA-N |
| InChI | InChI=1S/C19H20O8/c1-7-6-9(20)10-11(13(7)21)12-15(16(25-5)14(10)22)27-19(24)17(3,4)8(2)26-18(12,19)23/h6,8,22-24H,1-5H3/t8-,18-,19-/m1/s1 |
| SMILES | C[C@@H]1C([C@@]2([C@](O1)(C3=C(O2)C(=C(C4=C3C(=O)C(=CC4=O)C)O)OC)O)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Julianti, Elin; Lee, Jung-Ho; Liao, Lijuan; Park, Wanki; Park, Sunghyouk; Oh, Dong-Chan; Oh, Ki-Bong; Shin, Jongheon New polyaromatic metabolites from a marine-derived fungus Penicillium sp Organic Letters 2013 15 (6) 1286-1289. | ||
|---|---|---|---|
| DOI | 10.1021/ol4002174 | PMID | 23431962 |
