Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025045
PROPERTIES
| NPAID | NPA025045 |
|---|---|
| CLUSTER ID | 1607 |
| NODE ID | 1317 |
| NAME | Wortmannine B4 |
| FORMULA | C25H31NO9 |
| MOLECULAR WEIGHT (Da) | 489.5210 |
| ACCURATE MASS (Da) | 489.1999 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Niesslia |
| ORIGIN SPECIES | sp. TTI-0426 |
| InChIKey | QLBVXPPJNPNFMF-AQVWAYKISA-N |
| InChI | InChI=1S/C25H31NO9/c1-10(2)20(30)34-12-8-23(3)11(6-7-13(23)27)15-16(12)24(4)14(9-33-5)35-21(31)17-19(29)26-22(32)25(17,24)18(15)28/h10-12,14,17,19,29H,6-9H2,1-5H3,(H,26,32)/t11-,12+,14+,17-,19+,23-,24+,25-/m0/s1 |
| SMILES | CC(C)C(=O)O[C@@H]1C[C@]2([C@@H](CCC2=O)C3=C1[C@]4([C@H](OC(=O)[C@H]5[C@]4(C3=O)C(=O)N[C@@H]5O)COC)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Dischler NM; Xu L; Li Y; Nichols CB; Alspaugh JA; Bills GF; Gloer JB Wortmannin and Wortmannine Analogues from an Undescribed Niesslia sp. Journal of Natural Products 2019 82 (3) 532-538. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.8b00923 | PMID | 30844268 |
