Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000080614 | Gold | "MLS000876965-01!(6aR,9R,9aR)-9-acetyl-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-6a-methyl-9,9a-dihydrofuro[2,3-h]isochromene-6,8-dione" |
| CCMSLIB00004688956 | Bronze | Ochrephilone |
| CCMSLIB00004688957 | Bronze | Ochrephilone |
| CCMSLIB00004688958 | Bronze | Ochrephilone |
| CCMSLIB00004688959 | Bronze | Ochrephilone |
| CCMSLIB00004712748 | Bronze | Ochrephilone |
| CCMSLIB00004712749 | Bronze | Ochrephilone |
| CCMSLIB00004712750 | Bronze | Ochrephilone |
| CCMSLIB00004712751 | Bronze | Ochrephilone |
| CCMSLIB00004712752 | Bronze | Ochrephilone |
| CCMSLIB00004712753 | Bronze | Ochrephilone |
| CCMSLIB00004712754 | Bronze | Ochrephilone |
| CCMSLIB00004712755 | Bronze | Ochrephilone |
| CCMSLIB00004712756 | Bronze | Ochrephilone |
| CCMSLIB00004712757 | Bronze | Ochrephilone |
| CCMSLIB00004712758 | Bronze | Ochrephilone |
| CCMSLIB00004712759 | Bronze | Ochrephilone |
| CCMSLIB00004712760 | Bronze | Ochrephilone |
| CCMSLIB00004712761 | Bronze | Ochrephilone |
| CCMSLIB00004712762 | Bronze | Ochrephilone |
| CCMSLIB00000855714 | Gold | 1!CCMSLIB00000855715 |
| CCMSLIB00012128077 | Gold | 4 |
| CCMSLIB00012128078 | Gold | 4 |
| CCMSLIB00009967874 | Gold | 4 |
| CCMSLIB00009967875 | Gold | 4 |
COMPOUND NPA012983
PROPERTIES
| NPAID | NPA012983 |
|---|---|
| CLUSTER ID | 106 |
| NODE ID | 101 |
| NAME | Ochrephilone |
| FORMULA | C23H26O5 |
| MOLECULAR WEIGHT (Da) | 382.4560 |
| ACCURATE MASS (Da) | 382.1780 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | expansum KACC 40815 P |
| InChIKey | GAIVGINVGXHEIA-GHGIWVLHSA-N |
| InChI | InChI=1S/C23H26O5/c1-6-13(2)9-14(3)7-8-17-10-16-11-19(25)23(5)21(18(16)12-27-17)20(15(4)24)22(26)28-23/h7-13,20-21H,6H2,1-5H3/b8-7+,14-9+/t13-,20?,21?,23-/m0/s1 |
| SMILES | CC[C@H](C)/C=C(\C)/C=C/C1=CC2=CC(=O)[C@]3(C(C2=CO1)C(C(=O)O3)C(=O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Haruo Seto, Masato Tanabe Utilization of 13C-13C coupling in structural and biosynthetic studies. III. Ochrephilone - a new fungal metabolite Tetrahedron Letters 1974 15 (8) 651-654. | ||
|---|---|---|---|
| DOI | 10.1016/S0040-4039(01)82295-4 | PMID | - |
