Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002490
PROPERTIES
| NPAID | NPA002490 |
|---|---|
| CLUSTER ID | 1471 |
| NODE ID | 1212 |
| NAME | Rubellin F |
| FORMULA | C30H24O10 |
| MOLECULAR WEIGHT (Da) | 544.5120 |
| ACCURATE MASS (Da) | 544.1369 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Ramularia |
| ORIGIN SPECIES | collo-cygni |
| InChIKey | XQLAAGXBBHMPDD-LXRBGTOHSA-N |
| InChI | InChI=1S/C30H24O10/c1-11-7-14(22(29(39)40)18(33)8-11)27(37)30-10-12-9-19(34)23-24(20(12)15(30)5-6-17(32)28(30)38)25(35)13-3-2-4-16(31)21(13)26(23)36/h2-9,15,17,27-28,31-34,37-38H,10H2,1H3,(H,39,40)/t15-,17-,27+,28-,30+/m1/s1 |
| SMILES | CC1=CC(=C(C(=C1)O)C(=O)O)[C@@H]([C@]23CC4=CC(=C5C(=C4[C@H]2C=C[C@H]([C@H]3O)O)C(=O)C6=C(C5=O)C(=CC=C6)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Miethbauer, Sebastian; Haase, Susann; Schmidtke, Kai-Uwe; Guenther, Wolfgang; Heiser, Ingrid; Liebermann, Bernd Biosynthesis of photodynamically active rubellins and structure elucidation of new anthraquinone derivatives produced by Ramularia collo-cygni Phytochemistry 2006 67 (12) 1206-1213. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2006.05.003 | PMID | 16780904 |
