Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022361
PROPERTIES
| NPAID | NPA022361 |
|---|---|
| CLUSTER ID | 2231 |
| NODE ID | 1770 |
| NAME | Botrysphin E |
| FORMULA | C27H34O9 |
| MOLECULAR WEIGHT (Da) | 502.5600 |
| ACCURATE MASS (Da) | 502.2203 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Botryosphaeria |
| ORIGIN SPECIES | laricina |
| InChIKey | QRKUDJZMRTVQRY-SJJDIPSKSA-N |
| InChI | InChI=1S/C27H34O9/c1-6-25(4)10-11-27(34)14(13-25)17(29)20(32)22-24(2,3)8-7-9-26(22,27)23(33)36-21-15(28)12-16(35-5)18(30)19(21)31/h6,12-13,18-19,21,30-32,34H,1,7-11H2,2-5H3/t18-,19-,21+,25+,26+,27-/m1/s1 |
| SMILES | C[C@@]1(CC[C@]2(C(=C1)C(=O)C(=C3[C@@]2(CCCC3(C)C)C(=O)O[C@@H]4[C@@H]([C@@H](C(=CC4=O)OC)O)O)O)O)C=C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Peng-Liang; Han, Yang; Zhang, Long-Teng; Wang, Xiao-Ling; Shen, Tao; Ren, Dongmei; Lou, Hongxiang; Wang, Xiao-Ning Botrysphones A-C and Botrysphins A-F, Triketides and Diterpenoids from the Fungus Botrysphaeria laricina Journal of Natural Products 2017 80 (6) 1791-1797. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b01196 | PMID | 28609099 |
