Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005716843 | Gold | 3 |
COMPOUND NPA021186
PROPERTIES
| NPAID | NPA021186 |
|---|---|
| CLUSTER ID | 283 |
| NODE ID | 257 |
| NAME | Antipain |
| FORMULA | C27H44N10O6 |
| MOLECULAR WEIGHT (Da) | 604.7130 |
| ACCURATE MASS (Da) | 604.3445 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Unknown-bacterium |
| ORIGIN SPECIES | kC84-AG 13 |
| InChIKey | SDNYTAYICBFYFH-UWHLTILDSA-N |
| InChI | InChI=1S/C27H44N10O6/c1-16(2)21(23(40)34-18(15-38)10-6-12-32-25(28)29)37-22(39)19(11-7-13-33-26(30)31)35-27(43)36-20(24(41)42)14-17-8-4-3-5-9-17/h3-5,8-9,15-16,18-21H,6-7,10-14H2,1-2H3,(H,34,40)(H,37,39)(H,41,42)(H4,28,29,32)(H4,30,31,33)(H2,35,36,43)/t18-,19-,20+,21+/m0/s1 |
| SMILES | CC(C)[C@H](C(=O)N[C@@H](CCCN=C(N)N)C=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Suda H; Aoyagi T; Hamada M; Takeuchi T; Umezawa H ANTIPAIN, A NEW PROTEASE INHIBITOR ISOLATED FROM AGTINOMYCETES Journal of Antibiotics 1972 25 (4) 263-266. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.25.263 | PMID | 4559651 |
