Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024756
PROPERTIES
| NPAID | NPA024756 |
|---|---|
| CLUSTER ID | 664 |
| NODE ID | 590 |
| NAME | JBIR-100 |
| FORMULA | C39H60O11 |
| MOLECULAR WEIGHT (Da) | 704.8980 |
| ACCURATE MASS (Da) | 704.4136 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. RI18 |
| InChIKey | PQLOHEMXTLVMFP-NOUMOCAESA-N |
| InChI | InChI=1S/C39H60O11/c1-21(2)36-27(8)31(48-33(42)16-15-32(40)41)20-39(46,50-36)29(10)35(44)28(9)37-30(47-11)14-12-13-22(3)17-24(5)34(43)25(6)18-23(4)19-26(7)38(45)49-37/h12-16,18-19,21,24-25,27-31,34-37,43-44,46H,17,20H2,1-11H3,(H,40,41)/b14-12+,16-15+,22-13+,23-18+,26-19+ |
| SMILES | CC1C/C(=C/C=C/C(C(OC(=O)/C(=C/C(=C/C(C1O)C)/C)/C)C(C)C(C(C)C2(CC(C(C(O2)C(C)C)C)OC(=O)/C=C/C(=O)O)O)O)OC)/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ueda JY; Hashimoto J; Yamamura H; Hayakawa M; Takagi M; Shin-ya K A new 16-membered tetraene macrolide JBIR-100 from a newly identified Streptomyces species. Journal of Antibiotics 2010 63 (10) 627-629. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2010.104 | PMID | 20808316 |
