Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000892
PROPERTIES
| NPAID | NPA000892 |
|---|---|
| CLUSTER ID | 624 |
| NODE ID | 555 |
| NAME | Estatin A |
| FORMULA | C18H25N5O5 |
| MOLECULAR WEIGHT (Da) | 391.4280 |
| ACCURATE MASS (Da) | 391.1856 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudoalteromonas |
| ORIGIN SPECIES | sp. OT59 |
| InChIKey | CDANUSUTFSNLOG-HSBZDZAISA-N |
| InChI | InChI=1S/C18H25N5O5/c19-18(20)22-9-5-4-8-21-15(24)12(10-11-6-2-1-3-7-11)23-16(25)13-14(28-13)17(26)27/h1-3,6-7,12-14H,4-5,8-10H2,(H,21,24)(H,23,25)(H,26,27)(H4,19,20,22)/t12-,13?,14?/m0/s1 |
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)NCCCCN=C(N)N)NC(=O)C2C(O2)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yaginuma, Satoshi; Asahi, Akira; Morishita, Atsuki; Hayashi, Mitsuo; TSUJINO, MASATOSHI; TAKADA, MASAKI Isolation and characterization of new thiol protease inhibitors estatins A and B Journal of Antibiotics 1989 42 (9) 1362-1369. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.42.1362 | PMID | 2793591 |
