Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013609
PROPERTIES
| NPAID | NPA013609 |
|---|---|
| CLUSTER ID | 643 |
| NODE ID | 571 |
| NAME | Neopestalotin A |
| FORMULA | C23H31NO4 |
| MOLECULAR WEIGHT (Da) | 385.5040 |
| ACCURATE MASS (Da) | 385.2253 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Neopestalotiopsis |
| ORIGIN SPECIES | sp. |
| InChIKey | KGDKEXQNSMWPCR-FBBWCXSBSA-N |
| InChI | InChI=1S/C23H31NO4/c1-6-8-15-13(3)11-14-12-22(4,28)10-9-16(14)23(15,5)20(26)18-19(25)17(7-2)24-21(18)27/h6-8,11,14-16,25,28H,9-10,12H2,1-5H3,(H,24,27)/b8-6+,17-7-/t14-,15-,16-,22-,23-/m1/s1 |
| SMILES | C/C=C/[C@@H]1C(=C[C@@H]2C[C@](CC[C@H]2[C@]1(C)C(=O)C3=C(/C(=C/C)/NC3=O)O)(C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhao, Shasha; Chen, Shenxi; Wang, Bo; Niu, Shubin; Wu, Wenping; Guo, Liangdong; Che, Yongsheng Four new tetramic acid and one new furanone derivatives from the plant endophytic fungus Neopestalotiopsis sp Fitoterapia 2015 103 106-112. | ||
|---|---|---|---|
| DOI | 10.1016/j.fitote.2015.03.023 | PMID | 25818228 |
