Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00004685190 | Bronze | (3S)-8-hydroxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione |
| CCMSLIB00004685191 | Bronze | (3S)-8-hydroxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione |
| CCMSLIB00004685192 | Bronze | (3S)-8-hydroxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione |
| CCMSLIB00004685189 | Bronze | (3S)-8-hydroxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione |
| CCMSLIB00005489626 | Gold | 3 |
| CCMSLIB00000848009 | Gold | 1 |
| CCMSLIB00005722634 | Gold | 3 |
| CCMSLIB00005722632 | Gold | 3 |
| CCMSLIB00005722633 | Gold | 3 |
COMPOUND NPA013516
PROPERTIES
| NPAID | NPA013516 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | (+)-ochromycinone |
| FORMULA | C19H14O4 |
| MOLECULAR WEIGHT (Da) | 306.3170 |
| ACCURATE MASS (Da) | 306.0892 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | ZAWXOCUFQSQDJS-VIFPVBQESA-N |
| InChI | InChI=1S/C19H14O4/c1-9-7-10-5-6-12-17(15(10)14(21)8-9)19(23)11-3-2-4-13(20)16(11)18(12)22/h2-6,9,20H,7-8H2,1H3/t9-/m0/s1 |
| SMILES | C[C@H]1CC2=C(C(=O)C1)C3=C(C=C2)C(=O)C4=C(C3=O)C=CC=C4O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Bowie, J. H.; Johnson, A. W. The Structure of Ochromycinone Tetrahedron Letters 1967 8 (16) 1449-1452. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(00)90979-1 | PMID | - |
