Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA012539
PROPERTIES
NPAID | NPA012539 |
---|---|
CLUSTER ID | 429 |
NODE ID | 387 |
NAME | Ahpatinin Ac |
FORMULA | C34H55N5O9 |
MOLECULAR WEIGHT (Da) | 677.8400 |
ACCURATE MASS (Da) | 677.4000 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | MANPMNTVYKVAEV-DZBYZWQYSA-N |
InChI | InChI=1S/C34H55N5O9/c1-18(2)14-24(38-33(47)31(20(5)6)39-34(48)30(19(3)4)36-22(8)40)26(41)16-28(43)35-21(7)32(46)37-25(27(42)17-29(44)45)15-23-12-10-9-11-13-23/h9-13,18-21,24-27,30-31,41-42H,14-17H2,1-8H3,(H,35,43)(H,36,40)(H,37,46)(H,38,47)(H,39,48)(H,44,45)/t21-,24-,25-,26-,27-,30-,31-/m0/s1 |
SMILES | C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](CC(=O)O)O)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)C)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 |