Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000427298 | Gold | Microsclerodermin&L |
COMPOUND NPA010079
PROPERTIES
| NPAID | NPA010079 |
|---|---|
| CLUSTER ID | 3763 |
| NODE ID | 2825 |
| NAME | Microsclerodermin L |
| FORMULA | C41H51ClN8O13 |
| MOLECULAR WEIGHT (Da) | 899.3550 |
| ACCURATE MASS (Da) | 898.3264 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Sorangium |
| ORIGIN SPECIES | and |
| InChIKey | RUYOLBUZCDHXSS-ATUFKVTMSA-N |
| InChI | InChI=1S/C41H51ClN8O13/c1-50-20-31(55)46-27(13-22-17-43-26-14-23(42)11-12-25(22)26)38(59)45-19-30(54)44-18-24(51)15-29(53)47-33(34(57)28(52)10-6-9-21-7-4-3-5-8-21)35(58)39(60)48-37-36(63-2)40(61)49-41(37,62)16-32(50)56/h3-9,11-12,14,17,24,27-28,33-37,43,51-52,57-58,62H,10,13,15-16,18-20H2,1-2H3,(H,44,54)(H,45,59)(H,46,55)(H,47,53)(H,48,60)(H,49,61)/t24-,27-,28+,33-,34-,35+,36?,37-,41-/m1/s1 |
| SMILES | CN1CC(=O)N[C@@H](C(=O)NCC(=O)NC[C@@H](CC(=O)N[C@@H]([C@@H](C(=O)N[C@@H]2C(C(=O)N[C@]2(CC1=O)O)OC)O)[C@@H]([C@H](CC=CC3=CC=CC=C3)O)O)O)CC4=CNC5=C4C=CC(=C5)Cl |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hoffmann, Thomas; Müller, Stefan; Nadmid, Suvd; Garcia, Ronald; Müller, Rolf Microsclerodermins from Terrestrial Myxobacteria: An Intriguing Biosynthesis Likely Connected to a Sponge Symbiont Journal of the American Chemical Society 2013 135 (45) 16904-16911. | ||
|---|---|---|---|
| DOI | 10.1021/ja4054509 | PMID | 24124771 |
