Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000851779 | Gold | 1!CCMSLIB00000851782 |
COMPOUND NPA008431
PROPERTIES
| NPAID | NPA008431 |
|---|---|
| CLUSTER ID | 22 |
| NODE ID | 21 |
| NAME | Aigialomycin E |
| FORMULA | C18H22O6 |
| MOLECULAR WEIGHT (Da) | 334.3680 |
| ACCURATE MASS (Da) | 334.1416 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aigialus |
| ORIGIN SPECIES | parvus BCC 5311 |
| InChIKey | NHAQNKDEUQPSIX-FGXYAFLCSA-N |
| InChI | InChI=1S/C18H22O6/c1-11-5-4-8-15(21)14(20)7-3-2-6-12-9-13(19)10-16(22)17(12)18(23)24-11/h2,4,6,8-11,14-15,19-22H,3,5,7H2,1H3/b6-2-,8-4+/t11-,14+,15-/m1/s1 |
| SMILES | C[C@@H]1C/C=C/[C@H]([C@H](CC/C=C\C2=CC(=CC(=C2C(=O)O1)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Isaka, Masahiko; Suyarnsestakorn, Chotika; Tanticharoen, Morakot; Kongsaeree, Palangpon; Thebtaranonth, Yodhathai Aigialomycins A-E, new resorcylic macrolides from the marine mangrove fungus Aigialus parvus Journal of Organic Chemistry 2002 67 (5) 1561-1566. | ||
|---|---|---|---|
| DOI | 10.1021/jo010930g | PMID | 11871887 |
