Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005838
PROPERTIES
| NPAID | NPA005838 |
|---|---|
| CLUSTER ID | 16 |
| NODE ID | 16 |
| NAME | Macrosphelide I |
| FORMULA | C16H24O8 |
| MOLECULAR WEIGHT (Da) | 344.3600 |
| ACCURATE MASS (Da) | 344.1471 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Periconia |
| ORIGIN SPECIES | byssoides |
| InChIKey | KIBZGGIVYAKKPJ-VGOUJBTESA-N |
| InChI | InChI=1S/C16H24O8/c1-9-8-16(21)24-11(3)13(18)5-7-15(20)23-10(2)12(17)4-6-14(19)22-9/h4,6,9-13,17-18H,5,7-8H2,1-3H3/b6-4+/t9-,10+,11+,12-,13-/m1/s1 |
| SMILES | C[C@@H]1CC(=O)O[C@H]([C@@H](CCC(=O)O[C@H]([C@@H](/C=C/C(=O)O1)O)C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yamada, Takeshi; Iritani, Masashi; Doi, Mitsunobu; Minoura, Katsuhiko; Ito, Tadayoshi; Numata, Atsushi Absolute stereostructures of cell-adhesion inhibitors, macrosphelides C, E-G and I, produced by a Periconia species separated from an Aplysia sea hare Journal of the Chemical Society, Perkin Transactions 1 2001 (22) 3046-3053. | ||
|---|---|---|---|
| DOI | 10.1039/b104337b | PMID | - |
