Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014733
PROPERTIES
| NPAID | NPA014733 |
|---|---|
| CLUSTER ID | 5220 |
| NODE ID | 3698 |
| NAME | Acromelic acid A |
| FORMULA | C13H14N2O7 |
| MOLECULAR WEIGHT (Da) | 310.2620 |
| ACCURATE MASS (Da) | 310.0801 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Clitocybe |
| ORIGIN SPECIES | acromelalga |
| InChIKey | CWXNEBSQRIECMV-PJKMHFRUSA-N |
| InChI | InChI=1S/C13H14N2O7/c16-9(17)3-6-7(4-14-10(6)13(21)22)5-1-2-8(12(19)20)15-11(5)18/h1-2,6-7,10,14H,3-4H2,(H,15,18)(H,16,17)(H,19,20)(H,21,22)/t6-,7+,10-/m0/s1 |
| SMILES | C1[C@@H]([C@@H]([C@H](N1)C(=O)O)CC(=O)O)C2=CC=C(NC2=O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yamano, Kimiaki; Shirahama, Haruhisa New amino acids from clitocybe acromelalga. Possible intermediates in the biogenesis of mushroom toxins, acromelic acids Tetrahedron 1993 49 (12) 2427-2436. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4020(01)86321-3 | PMID | - |
