Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010661
PROPERTIES
| NPAID | NPA010661 |
|---|---|
| CLUSTER ID | 4229 |
| NODE ID | 2642 |
| NAME | Agnestadride A |
| FORMULA | C18H20O6 |
| MOLECULAR WEIGHT (Da) | 332.3520 |
| ACCURATE MASS (Da) | 332.1260 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Byssochlamys |
| ORIGIN SPECIES | fulva IMI 40021 |
| InChIKey | XYCWVVKRGCDXIK-UHFFFAOYSA-N |
| InChI | InChI=1S/C18H20O6/c1-3-5-7-10-12-9-8-11-14(17(21)23-15(11)19)13(6-4-2)18(12,22)24-16(10)20/h5,7,13,22H,3-4,6,8-9H2,1-2H3 |
| SMILES | CCCC1C2=C(CCC3=C(C(=O)OC13O)C=CCC)C(=O)OC2=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Szwalbe, Agnieszka J.; Williams, Katherine; O'Flynn, Daniel E.; Bailey, Andrew M.; Mulholland, Nicholas P.; Vincent, Jason L.; Willis, Christine L.; Cox, Russell J.; Simpson, Thomas J. Novel nonadride, heptadride and maleic acid metabolites from the byssochlamic acid producer Byssochlamys fulva IMI 40021-an insight into the biosynthesis of maleidrides Chemical Communications 2015 51 (96) 17088-17091. | ||
|---|---|---|---|
| DOI | 10.1039/c5cc06988b | PMID | 26452099 |
