Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA003930
PROPERTIES
| NPAID | NPA003930 |
|---|---|
| CLUSTER ID | 2115 |
| NODE ID | 1696 |
| NAME | Chlorocatechelin B |
| FORMULA | C18H25ClN4O8 |
| MOLECULAR WEIGHT (Da) | 460.8710 |
| ACCURATE MASS (Da) | 460.1361 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | AIPMDKSFYQRSQQ-CHWSQXEVSA-N |
| InChI | InChI=1S/C18H25ClN4O8/c19-11-6-5-10(14(25)15(11)26)16(27)21-12(3-1-7-20)17(28)22-13(18(29)30)4-2-8-23(31)9-24/h5-6,9,12-13,25-26,31H,1-4,7-8,20H2,(H,21,27)(H,22,28)(H,29,30)/t12-,13-/m1/s1 |
| SMILES | C1=CC(=C(C(=C1C(=O)N[C@H](CCCN)C(=O)N[C@H](CCCN(C=O)O)C(=O)O)O)O)Cl |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kishimoto, Shinji; Nishimura, Shinichi; Hattori, Akira; Tsujimoto, Masafumi; Hatano, Masaki; Igarashi, Masayuki; Kakeya, Hideaki Chlorocatechelins A and B from streptomyces sp.: New siderophores containing chlorinated catecholate groups and an acylguanidine structure Organic Letters 2014 16 (23) 6108-6111. | ||
|---|---|---|---|
| DOI | 10.1021/ol502964s | PMID | 25408968 |
