Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000852143 | Gold | 1!CCMSLIB00000852146 |
| CCMSLIB00012129877 | Gold | 4 |
| CCMSLIB00012129879 | Gold | 4 |
| CCMSLIB00012129881 | Gold | 4 |
| CCMSLIB00012129880 | Gold | 4 |
| CCMSLIB00012129878 | Gold | 4 |
| CCMSLIB00009969674 | Gold | 4 |
| CCMSLIB00009969676 | Gold | 4 |
| CCMSLIB00009969678 | Gold | 4 |
| CCMSLIB00009969677 | Gold | 4 |
| CCMSLIB00009969675 | Gold | 4 |
COMPOUND NPA015966
PROPERTIES
| NPAID | NPA015966 |
|---|---|
| CLUSTER ID | 63 |
| NODE ID | 59 |
| NAME | 12-Hydroxy-6-epi-albrassitriol |
| FORMULA | C15H26O4 |
| MOLECULAR WEIGHT (Da) | 270.3690 |
| ACCURATE MASS (Da) | 270.1831 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | sp. |
| InChIKey | HUZKUSWQRONLOJ-PAPYEOQZSA-N |
| InChI | InChI=1S/C15H26O4/c1-13(2)5-4-6-14(3)12(13)11(18)7-10(8-16)15(14,19)9-17/h7,11-12,16-19H,4-6,8-9H2,1-3H3/t11-,12+,14+,15-/m1/s1 |
| SMILES | C[C@]12CCCC([C@@H]1[C@@H](C=C([C@@]2(CO)O)CO)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | GRABLEY, SUSANNE; THIERICKE, RALF; ZERLIN, M.; GÖHRT, AXEL; PHILIPPS, SIEGRID; ZEECK, AXEL New Albrassitriols from Aspergillus sp. (FH-A 6357) Journal of Antibiotics 1996 49 (6) 593-595. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.49.593 | PMID | 8698644 |
