Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA026398
PROPERTIES
| NPAID | NPA026398 |
|---|---|
| CLUSTER ID | 7989 |
| NODE ID | 5431 |
| NAME | Graphostromol I |
| FORMULA | C12H18O4 |
| MOLECULAR WEIGHT (Da) | 226.2720 |
| ACCURATE MASS (Da) | 226.1205 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Graphostroma |
| ORIGIN SPECIES | sp. |
| InChIKey | ZAUVCPKOTKAFRS-WADGAMFQSA-N |
| InChI | InChI=1S/C12H18O4/c1-4-10(13)9(3)11(14)6-5-8(2)7-12(15)16/h5-7,9,11,14H,4H2,1-3H3,(H,15,16)/b6-5+,8-7+/t9-,11+/m1/s1 |
| SMILES | CCC(=O)[C@@H](C)[C@@H](O)/C=C/C(C)=C/C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Niu, Siwen; Xie, Chun-Lan; Xia, Jin-Mei; Zhong, Tianhua; Luo, Zhuhua; Shao, Zongze; Yang, Xian-Wen Graphostromols A–K, Eleven New Chained Polyketides from the Deep-Sea-Derived Graphostroma sp Chemistry and Biodiversity 2019 16 (9) None. | ||
|---|---|---|---|
| DOI | 10.1002/cbdv.201900326 | PMID | 31368179 |
