Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005887
PROPERTIES
| NPAID | NPA005887 |
|---|---|
| CLUSTER ID | 31 |
| NODE ID | 30 |
| NAME | Pyrrocidine B |
| FORMULA | C31H39NO4 |
| MOLECULAR WEIGHT (Da) | 489.6560 |
| ACCURATE MASS (Da) | 489.2879 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp., LL-Cyan426 |
| InChIKey | OCUONUXNKYDHKY-PZBKSWHFSA-N |
| InChI | InChI=1S/C31H39NO4/c1-6-20-12-18(4)25-24-23(20)27(33)22-15-31(35,32-29(22)34)14-19-7-9-21(10-8-19)36-28(24)26-17(3)11-16(2)13-30(25,26)5/h6-10,12,16-17,20,22-26,28,35H,1,11,13-15H2,2-5H3,(H,32,34)/t16-,17+,20-,22+,23+,24-,25+,26+,28+,30+,31-/m1/s1 |
| SMILES | C[C@@H]1C[C@@H]([C@H]2[C@@H]3[C@@H]4[C@H]([C@@H](C=C([C@@H]4[C@@]2(C1)C)C)C=C)C(=O)[C@@H]5C[C@](CC6=CC=C(O3)C=C6)(NC5=O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | He, Haiyin; Yang, Hui Y.; Bigelis, Ramunas; Solum, Eric H.; Greenstein, Michael; Carter, Guy T. Pyrrocidines A and B, new antibiotics produced by a filamentous fungus Tetrahedron Letters 2002 43 (9) 1633-1636. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(02)00099-0 | PMID | - |
