Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019413
PROPERTIES
| NPAID | NPA019413 |
|---|---|
| CLUSTER ID | 416 |
| NODE ID | 375 |
| NAME | Anabaenopeptin G |
| FORMULA | C49H67N7O11 |
| MOLECULAR WEIGHT (Da) | 930.1130 |
| ACCURATE MASS (Da) | 929.4899 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Oscillatoria |
| ORIGIN SPECIES | agardhii |
| InChIKey | HXYYQLNMRLHXGK-GMHCQXBESA-N |
| InChI | InChI=1S/C49H67N7O11/c1-6-29(3)41-45(62)50-27-9-8-10-37(52-49(67)53-39(48(65)66)28-33-15-23-36(59)24-16-33)43(60)54-42(30(4)7-2)46(63)51-38(25-17-31-11-19-34(57)20-12-31)47(64)56(5)40(44(61)55-41)26-18-32-13-21-35(58)22-14-32/h11-16,19-24,29-30,37-42,57-59H,6-10,17-18,25-28H2,1-5H3,(H,50,62)(H,51,63)(H,54,60)(H,55,61)(H,65,66)(H2,52,53,67)/t29-,30-,37+,38-,39-,40-,41-,42?/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)NCCCC[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N([C@H](C(=O)N1)CCC2=CC=C(C=C2)O)C)CCC3=CC=C(C=C3)O)[C@@H](C)CC)NC(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Itou, Y; Suzuki, S; Ishida, K; Murakami, M Anabaenopeptins G and H, potent carboxypeptidase A inhibitors from the cyanobacterium Oscillatoria agardhii (NIES-595) Bioorganic and Medicinal Chemistry Letters 1999 9 (9) 1243-1246. | ||
|---|---|---|---|
| DOI | 10.1016/s0960-894x(99)00191-2 | PMID | 10340607 |
