Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA029931
PROPERTIES
| NPAID | NPA029931 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Kailuin G |
| FORMULA | C38H69N5O9 |
| MOLECULAR WEIGHT (Da) | 739.9960 |
| ACCURATE MASS (Da) | 739.5095 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Photobacterium |
| ORIGIN SPECIES | halotolerans |
| InChIKey | MSDDJHUKLRPIMG-HQOXMFOCSA-N |
| InChI | InChI=1S/C38H69N5O9/c1-9-11-12-13-14-15-16-17-18-27-21-31(46)39-28(19-23(3)4)34(47)41-30(22-44)36(49)43-33(26(8)45)37(50)40-29(20-24(5)6)35(48)42-32(25(7)10-2)38(51)52-27/h23-30,32-33,44-45H,9-22H2,1-8H3,(H,39,46)(H,40,50)(H,41,47)(H,42,48)(H,43,49)/t25-,26+,27+,28+,29+,30-,32-,33-/m0/s1 |
| SMILES | CCCCCCCCCC[C@@H]1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Theodore, CM; Lorig-Roach, N; Still, PC; Johnson, TA; Drašković, M; Schwochert, JA; Naphen, CN; Crews, MS; Barker, SA; Valeriote, FA; Lokey, RS; Crews, P Biosynthetic products from a nearshore-derived gram-negative bacterium enable reassessment of the kailuin depsipeptides. Journal of Natural Products 2015 78 (3) 441-452. | ||
|---|---|---|---|
| DOI | 10.1021/np500840n | PMID | 25699470 |
