Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013727
PROPERTIES
| NPAID | NPA013727 |
|---|---|
| CLUSTER ID | 2031 |
| NODE ID | 1627 |
| NAME | Phomalairdenol A |
| FORMULA | C15H24O2 |
| MOLECULAR WEIGHT (Da) | 236.3550 |
| ACCURATE MASS (Da) | 236.1776 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Leptosphaeria |
| ORIGIN SPECIES | maculans |
| InChIKey | RPUQFKXVTKMLAL-JVHLPBCQSA-N |
| InChI | InChI=1S/C15H24O2/c1-9-10(16)7-11-13(2,3)8-14(4)12(17)5-6-15(9,11)14/h5-6,9-12,16-17H,7-8H2,1-4H3/t9-,10-,11+,12+,14-,15+/m1/s1 |
| SMILES | C[C@@H]1[C@@H](C[C@@H]2[C@]13C=C[C@@H]([C@]3(CC2(C)C)C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pedras, M Soledade C; Chumala, Paulos B; Venkatesham, Uppala New sesquiterpenic phytotoxins establish unprecedented relationship between different groups of blackleg fungal isolates Bioorganic and Medicinal Chemistry 2005 13 (7) 2469-2475. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmc.2005.01.040 | PMID | 15755649 |
