Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015771
PROPERTIES
| NPAID | NPA015771 |
|---|---|
| CLUSTER ID | 353 |
| NODE ID | 318 |
| NAME | Enterocin A |
| FORMULA | C49H70N14O16 |
| MOLECULAR WEIGHT (Da) | 1111.1810 |
| ACCURATE MASS (Da) | 1110.5094 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Enterococcus |
| ORIGIN SPECIES | faecium |
| InChIKey | UDJYWZUEIHCKKJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C49H70N14O16/c1-25(66)41(52)48(78)63-42(26(2)67)49(79)61-36(17-29-19-53-24-56-29)47(77)62-37(23-65)44(74)55-21-40(72)58-33(5-3-4-14-50)45(75)60-35(16-28-8-12-32(69)13-9-28)46(76)59-34(15-27-6-10-31(68)11-7-27)43(73)54-20-39(71)57-30(22-64)18-38(51)70/h6-13,19,22,24-26,30,33-37,41-42,65-69H,3-5,14-18,20-21,23,50,52H2,1-2H3,(H2,51,70)(H,53,56)(H,54,73)(H,55,74)(H,57,71)(H,58,72)(H,59,76)(H,60,75)(H,61,79)(H,62,77)(H,63,78) |
| SMILES | CC(C(C(=O)NC(C(C)O)C(=O)NC(CC1=CN=CN1)C(=O)NC(CO)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)NCC(=O)NC(CC(=O)N)C=O)N)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Aymerich,T; Holo,H; Håvarstein, L.S; Hugas,M; Garriga, M; Nes, I.F Biochemical and genetic characterization of enterocin A from Enterococcus faecium, a new antilisterial bacteriocin in the pediocin family of bacteriocins Applied and Environmental Microbiology 1996 62 (5) 1676-1682. | ||
|---|---|---|---|
| DOI | 10.5281/zenodo.3541320 | PMID | 8633865 |
