Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000347
PROPERTIES
| NPAID | NPA000347 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Unguisin C |
| FORMULA | C40H54N8O8 |
| MOLECULAR WEIGHT (Da) | 774.9200 |
| ACCURATE MASS (Da) | 774.4065 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Emericella |
| ORIGIN SPECIES | unguis |
| InChIKey | DYUXTXRHHWGWDU-FAPNWWIJSA-N |
| InChI | InChI=1S/C40H54N8O8/c1-22(2)33-39(55)45-29(18-25-12-7-6-8-13-25)37(53)48-34(23(3)4)40(56)46-31(21-49)38(54)44-30(19-26-20-42-28-15-10-9-14-27(26)28)36(52)41-17-11-16-32(50)43-24(5)35(51)47-33/h6-10,12-15,20,22-24,29-31,33-34,42,49H,11,16-19,21H2,1-5H3,(H,41,52)(H,43,50)(H,44,54)(H,45,55)(H,46,56)(H,47,51)(H,48,53)/t24-,29+,30-,31-,33-,34-/m1/s1 |
| SMILES | C[C@@H]1C(=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)NCCCC(=O)N1)CC2=CNC3=CC=CC=C32)CO)C(C)C)CC4=CC=CC=C4)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Malmstrom, Joan; Ryager, Anne; Anthoni, Uffe; Nielsen, Per Halfdan Unguisin C, a GABA-containing cyclic peptide from the fungus Emericella unguis Phytochemistry 2002 60 (8) 869-872. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(02)00150-4 | PMID | 12150814 |
