Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00006710026 | Gold | 3 |
COMPOUND NPA016544
PROPERTIES
| NPAID | NPA016544 |
|---|---|
| CLUSTER ID | 149 |
| NODE ID | 141 |
| NAME | Ngercheumicin G |
| FORMULA | C43H78N6O11 |
| MOLECULAR WEIGHT (Da) | 855.1280 |
| ACCURATE MASS (Da) | 854.5729 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Photobacterium |
| ORIGIN SPECIES | sp. |
| InChIKey | YZJJGQISMQALNG-RVQDSAONSA-N |
| InChI | InChI=1S/C43H78N6O11/c1-10-11-12-13-14-15-16-17-18-19-30(52)23-35(53)44-31(20-25(2)3)39(55)49-37-29(9)60-43(59)33(22-27(6)7)46-38(54)32(21-26(4)5)45-41(57)36(28(8)51)48-40(56)34(24-50)47-42(37)58/h25-34,36-37,50-52H,10-24H2,1-9H3,(H,44,53)(H,45,57)(H,46,54)(H,47,58)(H,48,56)(H,49,55)/t28-,29-,30?,31?,32?,33?,34+,36-,37-/m0/s1 |
| SMILES | CCCCCCCCCCCC(CC(=O)NC(CC(C)C)C(=O)N[C@H]1[C@@H](OC(=O)C(NC(=O)C(NC(=O)[C@@H](NC(=O)[C@H](NC1=O)CO)[C@H](C)O)CC(C)C)CC(C)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kjaerulff, Louise; Nielsen, Anita; Mansson, Maria; Gram, Lone; Larsen, Thomas O.; Ingmer, Hanne; Gotfredsen, Charlotte H. Identification of four new agr quorum sensing-interfering cyclodepsipeptides from a marine Photobacterium Marine Drugs 2013 11 (12) 5051-5062. | ||
|---|---|---|---|
| DOI | 10.3390/md11125051 | PMID | 24351904 |
