Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00012070145 | Gold | 3 |
COMPOUND NPA024956
PROPERTIES
| NPAID | NPA024956 |
|---|---|
| CLUSTER ID | 7600 |
| NODE ID | 5198 |
| NAME | Saccharonoic acid |
| FORMULA | C22H37NO3 |
| MOLECULAR WEIGHT (Da) | 363.5420 |
| ACCURATE MASS (Da) | 363.2773 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Saccharothrix |
| ORIGIN SPECIES | xinjiangensis Act24Zk |
| InChIKey | IDHWXSORJXHAOU-AUAOHMEYSA-N |
| InChI | InChI=1S/C22H37NO3/c1-16(2)8-7-9-17(3)12-19(5)14-20(6)13-18(4)10-11-21(24)23-15-22(25)26/h9-11,13,16,19-20H,7-8,12,14-15H2,1-6H3,(H,23,24)(H,25,26)/b11-10+,17-9+,18-13+/t19-,20+/m0/s1 |
| SMILES | C[C@H](C[C@H](C)/C=C(\C)/C=C/C(=O)NCC(=O)O)C/C(=C/CCC(C)C)/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Babadi ZK; Sudarman E; Ebrahimipour GH; Primahana G; Stadler M; Wink J Structurally diverse metabolites from the rare actinobacterium Saccharothrix xinjiangensis. Journal of Antibiotics 2020 73 (1) 48-55. | ||
|---|---|---|---|
| DOI | 10.1038/s41429-019-0223-7 | PMID | 31451754 |
