Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018009
PROPERTIES
NPAID | NPA018009 |
---|---|
CLUSTER ID | 429 |
NODE ID | 387 |
NAME | Ahpatinin Pr |
FORMULA | C35H57N5O9 |
MOLECULAR WEIGHT (Da) | 691.8670 |
ACCURATE MASS (Da) | 691.4156 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | INJPRCNVIPVODC-HEBMBFTFSA-N |
InChI | InChI=1S/C35H57N5O9/c1-9-28(43)39-31(20(4)5)35(49)40-32(21(6)7)34(48)38-24(15-19(2)3)26(41)17-29(44)36-22(8)33(47)37-25(27(42)18-30(45)46)16-23-13-11-10-12-14-23/h10-14,19-22,24-27,31-32,41-42H,9,15-18H2,1-8H3,(H,36,44)(H,37,47)(H,38,48)(H,39,43)(H,40,49)(H,45,46)/t22-,24-,25-,26-,27-,31-,32-/m0/s1 |
SMILES | CCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](CC(=O)O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Sun, Yi; Takada, Kentaro; Nogi, Yuichi; Okada, Shigeru; Matsunaga, Shigeki Lower homologues of ahpatinin, aspartic protease inhibitors, from a marine Streptomyces sp Journal of Natural Products 2014 77 (7) 1749-1752. | ||
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DOI | 10.1021/np500337m | PMID | 24960234 |