Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022046
PROPERTIES
| NPAID | NPA022046 |
|---|---|
| CLUSTER ID | 297 |
| NODE ID | 269 |
| NAME | Chloropreussomerin A |
| FORMULA | C21H15ClO8 |
| MOLECULAR WEIGHT (Da) | 430.7960 |
| ACCURATE MASS (Da) | 430.0455 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Lasiodiplodia |
| ORIGIN SPECIES | theobromae ZJ-HQ1 |
| InChIKey | DKRBXJDIXLMOMC-WWURCJJOSA-N |
| InChI | InChI=1S/C21H15ClO8/c1-27-13-7-10(24)8-3-2-4-11-15(8)20(13)28-12-6-5-9(23)14-16(12)21(29-11,30-20)19(26)17(22)18(14)25/h2-6,13,17,19,23,26H,7H2,1H3/t13-,17-,19-,20-,21+/m1/s1 |
| SMILES | CO[C@@H]1CC(=O)C2=C3[C@@]14OC5=C6C(=C(C=C5)O)C(=O)[C@H]([C@H]([C@]6(O4)OC3=CC=C2)O)Cl |
ORIGINAL ISOLATION REFERENCE
| CITATION | Chen, Senhua; Chen, Dongni; Cai, Runlin; Cui, Hui; Long, Yuhua; Lu, Yongjun; Li, Chunyuan; She, Zhigang Cytotoxic and Antibacterial Preussomerins from the Mangrove Endophytic Fungus Lasiodiplodia theobromae ZJ-HQ1 Journal of Natural Products 2016 79 (9) 2397-2402. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00639 | PMID | 27560695 |
