Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023248
PROPERTIES
| NPAID | NPA023248 |
|---|---|
| CLUSTER ID | 3445 |
| NODE ID | 2604 |
| NAME | Lactone acid n-butyl ester |
| FORMULA | C17H20O5 |
| MOLECULAR WEIGHT (Da) | 304.3420 |
| ACCURATE MASS (Da) | 304.1311 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Talaromyces |
| ORIGIN SPECIES | rugulosus |
| InChIKey | MBRSJCGZRGJMRR-UHFFFAOYSA-N |
| InChI | InChI=1S/C17H20O5/c1-2-3-11-21-14(18)10-9-13-15(16(19)17(20)22-13)12-7-5-4-6-8-12/h4-8,13,19H,2-3,9-11H2,1H3 |
| SMILES | CCCCOC(=O)CCC1C(=C(C(=O)O1)O)C2=CC=CC=C2 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Küppers, Lisa; Ebrahim, Weaam; El-Neketi, Mona; Özkaya, Ferhat C; Mándi, Attila; Kurtán, Tibor; Orfali, Raha S; Müller, Werner E G; Hartmann, Rudolf; Lin, Wenhan; Song, Weiguo; Liu, Zhen; Proksch, Peter Lactones from the Sponge-Derived Fungus Talaromyces rugulosus. Marine Drugs 2017 15 (11) None. | ||
|---|---|---|---|
| DOI | 10.3390/md15110359 | PMID | 29135916 |
