Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022538
PROPERTIES
| NPAID | NPA022538 |
|---|---|
| CLUSTER ID | 139 |
| NODE ID | 132 |
| NAME | Niphimycin C |
| FORMULA | C59H103N3O18 |
| MOLECULAR WEIGHT (Da) | 1142.4760 |
| ACCURATE MASS (Da) | 1141.7237 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. IMB7-145 |
| InChIKey | XUFXJNAQSHPBTO-IVEPKIRNSA-N |
| InChI | InChI=1S/C59H103N3O18/c1-34(18-14-12-10-11-13-17-25-62-58(60)61-9)26-38(5)55-37(4)19-15-16-20-45(64)39(6)49(68)29-43(78-54(74)32-53(72)73)27-42(63)28-44-30-51(70)56(75)59(77,80-44)33-52(71)36(3)22-23-46(65)40(7)50(69)31-48(67)35(2)21-24-47(66)41(8)57(76)79-55/h10-11,15-16,19-21,24,34-52,55-56,63-71,75,77H,12-14,17-18,22-23,25-33H2,1-9H3,(H,72,73)(H3,60,61,62)/b11-10+,19-15+,20-16+,24-21+/t34-,35-,36-,37-,38-,39+,40+,41+,42-,43-,44+,45+,46-,47+,48+,49+,50-,51-,52+,55-,56+,59-/m0/s1 |
| SMILES | C[C@H]1CC[C@@H]([C@H]([C@H](C[C@H]([C@H](/C=C/[C@H]([C@H](C(=O)O[C@@H]([C@H](/C=C/C=C/[C@H]([C@H]([C@@H](C[C@H](C[C@@H](C[C@@H]2C[C@@H]([C@H]([C@@](O2)(C[C@H]1O)O)O)O)O)OC(=O)CC(=O)O)O)C)O)C)[C@@H](C)C[C@@H](C)CCC/C=C/CCCNC(=NC)N)C)O)C)O)O)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hu, Yuanyuan; Wang, Mian; Wu, Chunyan; Tan, Yi; Li, Jiao; Hao, Xiaomeng; Duan, Yanbo; Guan, Yan; Shang, Xiaoya; Wang, Yiguang; Xiao, Chunling; Gan, Maoluo Identification and Proposed Relative and Absolute Configurations of Niphimycins C-E from the Marine-Derived Streptomyces sp. IMB7-145 by Genomic Analysis Journal of Natural Products 2018 81 (1) 178-187. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.7b00859 | PMID | 29308897 |
