Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025374
PROPERTIES
| NPAID | NPA025374 |
|---|---|
| CLUSTER ID | 7684 |
| NODE ID | 5249 |
| NAME | Aphidicolin A48 |
| FORMULA | C20H32O4 |
| MOLECULAR WEIGHT (Da) | 336.4720 |
| ACCURATE MASS (Da) | 336.2301 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Botryotinia |
| ORIGIN SPECIES | fuckeliana MCCC 3A00494 |
| InChIKey | SFYFCRSKCFIBEC-YNZDMMAESA-N |
| InChI | InChI=1S/C20H32O4/c1-17(2)5-4-6-18(3)16(17)14(22)9-12-15(23)13-10-19(12,18)7-8-20(13,24)11-21/h9,13-16,21-24H,4-8,10-11H2,1-3H3/t13-,14-,15-,16-,18-,19-,20-/m0/s1 |
| SMILES | C[C@]12CCCC([C@@H]1[C@H](C=C3[C@@]24CC[C@@]([C@@H](C4)[C@H]3O)(CO)O)O)(C)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 |
