Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00004679299 | Bronze | Putative&orfamide&B |
| CCMSLIB00000577591 | Gold | 3 |
| CCMSLIB00012140950 | Gold | 4 |
| CCMSLIB00012140952 | Gold | 4 |
| CCMSLIB00012140954 | Gold | 4 |
| CCMSLIB00012140953 | Gold | 4 |
| CCMSLIB00012140951 | Gold | 4 |
| CCMSLIB00009980747 | Gold | 4 |
| CCMSLIB00009980749 | Gold | 4 |
| CCMSLIB00009980751 | Gold | 4 |
| CCMSLIB00009980750 | Gold | 4 |
| CCMSLIB00009980748 | Gold | 4 |
COMPOUND NPA002140
PROPERTIES
| NPAID | NPA002140 |
|---|---|
| CLUSTER ID | 149 |
| NODE ID | 141 |
| NAME | Orfamide B |
| FORMULA | C63H112N10O17 |
| MOLECULAR WEIGHT (Da) | 1281.6420 |
| ACCURATE MASS (Da) | 1280.8207 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudomonas |
| ORIGIN SPECIES | fluorescens Pf-5 |
| InChIKey | FPMIEPCWEZBKGP-UHFFFAOYSA-N |
| InChI | InChI=1S/C63H112N10O17/c1-15-16-17-18-19-20-21-22-23-24-41(76)31-49(77)64-43(27-34(2)3)55(81)65-42(25-26-50(78)79)54(80)73-53-40(14)90-63(89)52(39(12)13)72-60(86)48(33-75)70-57(83)45(29-36(6)7)66-56(82)44(28-35(4)5)67-59(85)47(32-74)69-58(84)46(30-37(8)9)68-61(87)51(38(10)11)71-62(53)88/h34-48,51-53,74-76H,15-33H2,1-14H3,(H,64,77)(H,65,81)(H,66,82)(H,67,85)(H,68,87)(H,69,84)(H,70,83)(H,71,88)(H,72,86)(H,73,80)(H,78,79) |
| SMILES | CCCCCCCCCCCC(CC(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC1C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)C(C)C)CC(C)C)CO)CC(C)C)CC(C)C)CO)C(C)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Gross, Harald; Stockwell, Virginia O; Henkels, Marcella D; Nowak-Thompson, Brian; Loper, Joyce E; Gerwick, William H The genomisotopic approach: a systematic method to isolate products of orphan biosynthetic gene clusters Chemistry & Biology 2007 14 (1) 53. | ||
|---|---|---|---|
| DOI | 10.1016/j.chembiol.2006.11.007 | PMID | 17254952 |
