Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007780
PROPERTIES
| NPAID | NPA007780 |
|---|---|
| CLUSTER ID | 3441 |
| NODE ID | 2603 |
| NAME | Jahnellamide A |
| FORMULA | C44H54N10O12S |
| MOLECULAR WEIGHT (Da) | 947.0410 |
| ACCURATE MASS (Da) | 946.3643 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Jahnella |
| ORIGIN SPECIES | sp. |
| InChIKey | RIJAUTKWSDWZAH-MDUPEUTGSA-N |
| InChI | InChI=1S/C44H54N10O12S/c1-67-19-15-28-36(58)43(65)52-31(21-34(56)42(64)46-16-18-55)40(62)51-30(20-25-22-47-27-11-6-5-10-26(25)27)39(61)50-29(13-14-35(45)57)38(60)48-23-32(53-37(59)24-8-3-2-4-9-24)44(66)54-17-7-12-33(54)41(63)49-28/h2-6,8-11,20,22,28-29,31-34,47,55-56H,7,12-19,21,23H2,1H3,(H2,45,57)(H,46,64)(H,48,60)(H,49,63)(H,50,61)(H,51,62)(H,52,65)(H,53,59)/b30-20-/t28-,29+,31+,32-,33-,34-/m0/s1 |
| SMILES | CSCC[C@H]1C(=O)C(=O)N[C@@H](C(=O)N/C(=C\C2=CNC3=CC=CC=C32)/C(=O)N[C@@H](C(=O)NC[C@@H](C(=O)N4CCC[C@H]4C(=O)N1)NC(=O)C5=CC=CC=C5)CCC(=O)N)C[C@@H](C(=O)NCCO)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Plaza, Alberto; Viehrig, Konrad; Garcia, Ronald; Mueller, Rolf Jahnellamides, α-keto-β-methionine-containing peptides from the terrestrial myxobacterium jahnella sp.: Structure and biosynthesis Organic Letters 2013 15 (22) 5882-5885. | ||
|---|---|---|---|
| DOI | 10.1021/ol402967y | PMID | 24199909 |
