Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015067
PROPERTIES
| NPAID | NPA015067 |
|---|---|
| CLUSTER ID | 1499 |
| NODE ID | 1231 |
| NAME | Quinocinnolinomycin B |
| FORMULA | C23H33N3O3 |
| MOLECULAR WEIGHT (Da) | 399.5350 |
| ACCURATE MASS (Da) | 399.2522 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | HKRWFFVOAZIRBL-GOSISDBHSA-N |
| InChI | InChI=1S/C23H33N3O3/c1-3-4-5-6-7-8-9-10-11-12-18(27)14-13-17-15-19-21(28)16-20(24-2)23(29)22(19)26-25-17/h13-16,18,24,27H,3-12H2,1-2H3/t18-/m1/s1 |
| SMILES | CCCCCCCCCCC[C@@H](O)C=CC1=CC2=C(N=N1)C(=O)C(NC)=CC2=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kurita, Kenji L.; Glassey, Emerson; Linington, Roger G. Integration of high-content screening and untargeted metabolomics for comprehensive functional annotation of natural product libraries Proceedings of the National Academy of Sciences of the United States of America 2015 112 (39) 11999-12004. | ||
|---|---|---|---|
| DOI | 10.1073/pnas.1507743112 | PMID | 26371303 |
