Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA030198
PROPERTIES
| NPAID | NPA030198 |
|---|---|
| CLUSTER ID | 1210 |
| NODE ID | 1029 |
| NAME | Thalassospiramide A10 |
| FORMULA | C46H73N7O13 |
| MOLECULAR WEIGHT (Da) | 932.1260 |
| ACCURATE MASS (Da) | 931.5266 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Thalassospira |
| ORIGIN SPECIES | sp. |
| InChIKey | AUXLHZFWDLSFFN-MEKHSURISA-N |
| InChI | InChI=1S/C46H73N7O13/c1-9-10-11-12-13-14-36(58)48-33(24-55)42(61)52-40(27(4)5)44(63)49-32(23-54)35(57)22-38(60)51-39(26(2)3)43(62)47-30-17-20-37(59)50-41(28(6)7)45(64)53(8)34(46(65)66-25-30)21-29-15-18-31(56)19-16-29/h15-20,26-28,30,32-35,39-41,54-57H,9-14,21-25H2,1-8H3,(H,47,62)(H,48,58)(H,49,63)(H,50,59)(H,51,60)(H,52,61)/b20-17+/t30-,32+,33+,34+,35+,39+,40+,41+/m1/s1 |
| SMILES | CCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)[C@@H](O)CC(=O)N[C@H](C(=O)N[C@@H]1/C=C/C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(O)C=C2)C(=O)OC1)C(C)C)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, W; Lu, L; Lai, Q; Zhu, B; Li, Z; Xu, Y; Shao, Z; Herrup, K; Moore, BS; Ross, AC; Qian, PY Family-wide Structural Characterization and Genomic Comparisons Decode the Diversity-oriented Biosynthesis of Thalassospiramides by Marine Proteobacteria. Journal of Biological Chemistry 2016 291 (53) 27228-27238. | ||
|---|---|---|---|
| DOI | 10.1074/jbc.M116.756858 | PMID | 27875306 |
