Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA006663
PROPERTIES
NPAID | NPA006663 |
---|---|
CLUSTER ID | 3071 |
NODE ID | 20 |
NAME | Chaetocyclinone C |
FORMULA | C32H24O14 |
MOLECULAR WEIGHT (Da) | 632.5300 |
ACCURATE MASS (Da) | 632.1166 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Chaetomium |
ORIGIN SPECIES | sp. (strain Gö 100/2) |
InChIKey | XWXMXQKIUMKPJQ-UHFFFAOYSA-N |
InChI | InChI=1S/C32H24O14/c1-11(33)13-7-16-25(36)24-15(32(40)44-6)9-20(42-4)27(38)30(24)46-28(16)21(12(2)34)23(13)18-10-17(35)22-14(31(39)43-5)8-19(41-3)26(37)29(22)45-18/h7-10,37-38H,1-6H3 |
SMILES | CC(=O)C1=C(C(=C2C(=C1)C(=O)C3=C(O2)C(=C(C=C3C(=O)OC)OC)O)C(=O)C)C4=CC(=O)C5=C(O4)C(=C(C=C5C(=O)OC)OC)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Lösgen, Sandra; Schlörke, Oliver; Meindl, Kathrin; Herbst-Irmer, Regine; Zeeck, Axel Structure and Biosynthesis of Chaetocyclinones, New Polyketides Produced by an Endosymbiotic Fungus European Journal of Organic Chemistry 2007 2007 (13) 2191-2196. | ||
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DOI | 10.1002/ejoc.200601020 | PMID | - |