Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022414
PROPERTIES
| NPAID | NPA022414 |
|---|---|
| CLUSTER ID | 6905 |
| NODE ID | 4770 |
| NAME | Seco-PF1233 B carboxylic acid |
| FORMULA | C25H28N2O6 |
| MOLECULAR WEIGHT (Da) | 452.5070 |
| ACCURATE MASS (Da) | 452.1947 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | sp. MEXU 27854 |
| InChIKey | TXVLBRMNUYNGCT-KMEZTADASA-N |
| InChI | InChI=1S/C25H28N2O6/c1-4-24(2,3)25(16-11-8-12-18(28)20(16)27-23(25)33)14-17(22(31)32)26-21(30)19(29)13-15-9-6-5-7-10-15/h4-12,17,19,28-29H,1,13-14H2,2-3H3,(H,26,30)(H,27,33)(H,31,32)/t17-,19-,25-/m0/s1 |
| SMILES | CC(C)(C=C)[C@]1(C2=C(C(=CC=C2)O)NC1=O)C[C@@H](C(=O)O)NC(=O)[C@H](CC3=CC=CC=C3)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Aparicio-Cuevas, Manuel A.; Rivero-Cruz, Isabel; Sánchez-Castellanos, Mariano; Menéndez, Daniel; Raja, Huzefa A.; Joseph-Nathan, Pedro; González, María Del Carmen; Figueroa, Mario Dioxomorpholines and Derivatives from a Marine-Facultative Aspergillus Species Journal of Natural Products 2017 80 (8) 2311-2318. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.7b00331 | PMID | 28796494 |
