Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011658
PROPERTIES
| NPAID | NPA011658 |
|---|---|
| CLUSTER ID | 4497 |
| NODE ID | 3293 |
| NAME | α-Rubromycin |
| FORMULA | C27H20O12 |
| MOLECULAR WEIGHT (Da) | 536.4450 |
| ACCURATE MASS (Da) | 536.0955 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | collinus |
| InChIKey | LQNGOIZVRFNQLO-UHFFFAOYSA-N |
| InChI | InChI=1S/C27H20O12/c1-35-14-9-15(36-2)22(30)19-18(14)21(29)13-8-12(38-25(13)24(19)32)5-4-10-6-11-7-16(26(33)37-3)39-27(34)17(11)23(31)20(10)28/h6-9,28,30-31H,4-5H2,1-3H3 |
| SMILES | COC1=CC(=C(C2=C1C(=O)C3=C(C2=O)OC(=C3)CCC4=C(C(=C5C(=C4)C=C(OC5=O)C(=O)OC)O)O)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Brockmann, Hans; Zeeck, Axel Rubromycine, III. Die Konstitution von α-Rubromycin, β-Rubromycin, γ-Rubromycin und γ-iso-Rubromycin Chemische Berichte 1970 103 (6) 1709-1726. | ||
|---|---|---|---|
| DOI | 10.1002/cber.19701030607 | PMID | 25855820 |
