Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006880
PROPERTIES
| NPAID | NPA006880 |
|---|---|
| CLUSTER ID | 3149 |
| NODE ID | 2406 |
| NAME | Vulnibactin |
| FORMULA | C35H39N5O9 |
| MOLECULAR WEIGHT (Da) | 673.7230 |
| ACCURATE MASS (Da) | 673.2748 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Vibrio |
| ORIGIN SPECIES | vulnificus |
| InChIKey | CYQRDZPBFHTFJZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C35H39N5O9/c1-20-28(38-33(48-20)22-10-3-5-13-25(22)41)32(46)37-17-9-19-40(18-8-16-36-31(45)24-12-7-15-27(43)30(24)44)35(47)29-21(2)49-34(39-29)23-11-4-6-14-26(23)42/h3-7,10-15,20-21,28-29,41-44H,8-9,16-19H2,1-2H3,(H,36,45)(H,37,46) |
| SMILES | CC1C(N=C(O1)C2=CC=CC=C2O)C(=O)NCCCN(CCCNC(=O)C3=C(C(=CC=C3)O)O)C(=O)C4C(OC(=N4)C5=CC=CC=C5O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Okujo, N; Saito, M; Yamamot,o S; Yoshida, T; Miyoshi, S; Shinoda, S InvoStructure of vulnibactin, a new polyamine-containing siderophore from Vibrio vulnificus BioMetals 1994 7 (2) 109-116. | ||
|---|---|---|---|
| DOI | 10.1007/bf00140480 | PMID | 8148612 |
