Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002536
PROPERTIES
| NPAID | NPA002536 |
|---|---|
| CLUSTER ID | 1499 |
| NODE ID | 1231 |
| NAME | quinocinnolinomycin C |
| FORMULA | C24H35N3O3 |
| MOLECULAR WEIGHT (Da) | 413.5620 |
| ACCURATE MASS (Da) | 413.2678 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | WTRVVOIWIXMDPH-WHCXFUJUSA-N |
| InChI | InChI=1S/C24H35N3O3/c1-4-17(2)11-9-7-5-6-8-10-12-19(28)14-13-18-15-20-22(29)16-21(25-3)24(30)23(20)27-26-18/h13-17,19,25,28H,4-12H2,1-3H3/t17?,19-/m1/s1 |
| SMILES | CCC(C)CCCCCCCC[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 |
