Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020188
PROPERTIES
| NPAID | NPA020188 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Gageopeptin B |
| FORMULA | C52H91N7O13 |
| MOLECULAR WEIGHT (Da) | 1022.3360 |
| ACCURATE MASS (Da) | 1021.6675 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | sp. 109GGC020 |
| InChIKey | ZJBYJHYERISUES-HNAGHXPISA-N |
| InChI | InChI=1S/C52H91N7O13/c1-12-34(10)21-19-17-15-13-14-16-18-20-22-36-28-42(60)54-37(23-24-43(61)62)47(66)59-45(33(8)9)51(70)57-38(25-30(2)3)48(67)53-35(11)46(65)55-40(29-44(63)64)50(69)56-39(26-31(4)5)49(68)58-41(27-32(6)7)52(71)72-36/h30-41,45H,12-29H2,1-11H3,(H,53,67)(H,54,60)(H,55,65)(H,56,69)(H,57,70)(H,58,68)(H,59,66)(H,61,62)(H,63,64)/t34?,35-,36+,37-,38-,39-,40+,41+,45+/m0/s1 |
| SMILES | CCC(C)CCCCCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O1)CC(C)C)CC(C)C)CC(=O)O)C)CC(C)C)C(C)C)CCC(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tareq, Fakir Shahidullah; Hasan, Choudhury M.; Lee, Hyi-Seung; Lee, Yeon-Ju; Lee, Jong Seok; Surovy, Musrat Zahan; Islam, Md. Tofazzal; Shin, Hee Jae Gageopeptins A and B, new inhibitors of zoospore motility of the phytopathogen Phytophthora capsici from a marine-derived bacterium Bacillus sp. 109GGC020 Bioorganic and Medicinal Chemistry Letters 2015 25 (16) 3325-3329. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmcl.2015.05.070 | PMID | 26071635 |
