Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005724004 | Gold | 3 |
| CCMSLIB00000001723 | Gold | 1 |
| CCMSLIB00005724017 | Gold | 3 |
COMPOUND NPA022313
PROPERTIES
| NPAID | NPA022313 |
|---|---|
| CLUSTER ID | 6875 |
| NODE ID | 4753 |
| NAME | Cryptomaldamide |
| FORMULA | C18H33N5O5 |
| MOLECULAR WEIGHT (Da) | 399.4920 |
| ACCURATE MASS (Da) | 399.2482 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Moorea |
| ORIGIN SPECIES | producens |
| InChIKey | FUCBQNSQRCPSGC-BOUYHWOHSA-N |
| InChI | InChI=1S/C18H33N5O5/c1-9(2)13(7-11(5)17(27)28)23(6)16(26)14(10(3)4)22-15(25)12(8-24)21-18(19)20/h7,9-10,12-14,24H,8H2,1-6H3,(H,22,25)(H,27,28)(H4,19,20,21)/b11-7+/t12-,13+,14-/m0/s1 |
| SMILES | CC(C)[C@@H](/C=C(\C)/C(=O)O)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](CO)N=C(N)N |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kinnel, Robin B.; Esquenazi, Eduardo; Leao, Tiago; Moss, Nathan; Mevers, Emily; Pereira, Alban R.; Monroe, Emily A.; Korobeynikov, Anton; Murray, Thomas F.; Sherman, David; Gerwick, Lena; Dorrestein, Pieter C.; Gerwick, William H. A Maldiisotopic Approach to Discover Natural Products: Cryptomaldamide, a Hybrid Tripeptide from the Marine Cyanobacterium Moorea producens Journal of Natural Products 2017 80 (5) 1514-1521. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.7b00019 | PMID | 28448144 |
