Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025348
PROPERTIES
| NPAID | NPA025348 |
|---|---|
| CLUSTER ID | 7684 |
| NODE ID | 5249 |
| NAME | Aphidicolin A24 |
| FORMULA | C22H34O5 |
| MOLECULAR WEIGHT (Da) | 378.5090 |
| ACCURATE MASS (Da) | 378.2406 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Botryotinia |
| ORIGIN SPECIES | fuckeliana MCCC 3A00494 |
| InChIKey | TUTOSPSPBZUUEE-ALHBQKHBSA-N |
| InChI | InChI=1S/C22H34O5/c1-14(24)27-13-19(2)17-5-4-15-10-16-11-21(15,8-9-22(16,26)12-23)20(17,3)7-6-18(19)25/h10,16-18,23,25-26H,4-9,11-13H2,1-3H3/t16-,17+,18-,19+,20+,21+,22+/m1/s1 |
| SMILES | CC(=O)OC[C@]1([C@@H]2CCC3=C[C@@H]4C[C@@]3([C@]2(CC[C@H]1O)C)CC[C@@]4(CO)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Niu S; Xia JM; Li Z; Yang LH; Yi ZW; Xie CL; Peng G; Luo ZH; Shao Z; Yang XW Aphidicolin Chemistry of the Deep-Sea-Derived Fungus Botryotinia fuckeliana MCCC 3A00494. Journal of Natural Products 2019 82 (8) 2307-2331. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.9b00705 | PMID | 31403790 |
