Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011351
PROPERTIES
| NPAID | NPA011351 |
|---|---|
| CLUSTER ID | 1492 |
| NODE ID | 1226 |
| NAME | Hygrocin B |
| FORMULA | C28H29NO8 |
| MOLECULAR WEIGHT (Da) | 507.5390 |
| ACCURATE MASS (Da) | 507.1893 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | hygroscopicus |
| InChIKey | YCXQGZJYZGFQSB-MGRGBYLISA-N |
| InChI | InChI=1S/C28H29NO8/c1-5-15-6-8-17(30)14(3)37-27(36)28(4)11-10-19(32)29-23-22(28)26(35)20-16(25(23)34)12-13(2)24(33)21(20)18(31)9-7-15/h6,8,10-12,14-15,17,30,33H,5,7,9H2,1-4H3,(H,29,32)/t14-,15?,17-,28-/m0/s1 |
| SMILES | CCC1CCC(=O)C2=C3C(=CC(=C2O)C)C(=O)C4=C(C3=O)[C@](C=CC(=O)N4)(C(=O)O[C@H]([C@H](C=C1)O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cai, Ping; Kong, Fangming; Ruppen, Mark E.; Glasier, Greg; Carter, Guy T. Hygrocins A and B, naphthoquinone macrolides from Streptomyces hygroscopicus Journal of Natural Products 2005 68 (12) 1736-1742. | ||
|---|---|---|---|
| DOI | 10.1021/np050272l | PMID | 16378365 |
SYNTHESES
| CITATION 1 | Nawrat CC; Kitson RR; Moody CJ Toward the total synthesis of hygrocin B and divergolide C: construction of the naphthoquinone-azepinone core. Organic Letters 2014 16 (7) 1896-9. DOI: 10.1021/ol5003847 PMID: 24661134 | ||
|---|---|---|---|
