Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017556
PROPERTIES
| NPAID | NPA017556 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Unguisin B |
| FORMULA | C37H56N8O7 |
| MOLECULAR WEIGHT (Da) | 724.9040 |
| ACCURATE MASS (Da) | 724.4272 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Emericella |
| ORIGIN SPECIES | unguis |
| InChIKey | STCFDPSTGTYYBQ-MDODTGCMSA-N |
| InChI | InChI=1S/C37H56N8O7/c1-19(2)16-27-35(50)45-30(20(3)4)36(51)41-23(8)32(47)42-28(17-24-18-39-26-13-10-9-12-25(24)26)34(49)38-15-11-14-29(46)40-22(7)33(48)44-31(21(5)6)37(52)43-27/h9-10,12-13,18-23,27-28,30-31,39H,11,14-17H2,1-8H3,(H,38,49)(H,40,46)(H,41,51)(H,42,47)(H,43,52)(H,44,48)(H,45,50)/t22-,23-,27+,28-,30-,31-/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)C)C(C)C)CC(C)C)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Malmstrom, Joan Unguisins A and B: New cyclic peptides from the marine-derived fungus Emericella unguis Journal of Natural Products 1999 62 (5) 787-789. | ||
|---|---|---|---|
| DOI | 10.1021/np980539z | PMID | 10346973 |
