Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000850181 | Gold | 1 |
| CCMSLIB00012137179 | Gold | 4 |
| CCMSLIB00009976976 | Gold | 4 |
COMPOUND NPA021620
PROPERTIES
| NPAID | NPA021620 |
|---|---|
| CLUSTER ID | 54 |
| NODE ID | 52 |
| NAME | Simamycin |
| FORMULA | C19H28N2O6 |
| MOLECULAR WEIGHT (Da) | 380.4410 |
| ACCURATE MASS (Da) | 380.1947 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | AXWLJQKHNCEKHK-ZGFVZBPKSA-N |
| InChI | InChI=1S/C19H28N2O6/c1-12(2)5-4-6-13(3)8-10-26-11-14-16(23)17(24)18(27-14)21-9-7-15(22)20-19(21)25/h5,7-9,14,16-18,23-24H,4,6,10-11H2,1-3H3,(H,20,22,25)/b13-8+/t14-,16-,17-,18-/m1/s1 |
| SMILES | CC(=CCC/C(=C/COC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O)/C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Igarashi, Yasuhiro; Kyoso, Takayuki; Kim, Youngju; Oikawa, Tsutomu Simamycin (5′-O-geranyluridine): A new prenylated nucleoside from Streptomyces sp. Journal of Antibiotics 2017 70 (5) 607-610. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2016.163 | PMID | 28096544 |
