Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016469
PROPERTIES
NPAID | NPA016469 |
---|---|
CLUSTER ID | 5623 |
NODE ID | 3982 |
NAME | Dawenol |
FORMULA | C28H42O3 |
MOLECULAR WEIGHT (Da) | 426.6410 |
ACCURATE MASS (Da) | 426.3134 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Stigmatella |
ORIGIN SPECIES | aurantiaca DW4/3-1 |
InChIKey | NJOUGKMJLWWKLH-XLWWUSDISA-N |
InChI | InChI=1S/C28H42O3/c1-10-13-20(2)14-11-15-21(3)16-12-17-22(4)18-23(5)19-24(6)28(30)25(7)26(8)31-27(9)29/h10-19,23,25-26,28,30H,1-9H3/b13-10-,15-11+,17-12+,20-14+,21-16+,22-18+,24-19+ |
SMILES | C/C=C\C(=C\C=C\C(=C\C=C\C(=C\C(C)/C=C(\C)/C(C(C)C(C)OC(=O)C)O)\C)\C)\C |
ORIGINAL ISOLATION REFERENCE
CITATION | Söker, Udo; Kunze, Brigitte; Reichenbach, Hans; Höfle, Gerhard Dawenol, a New Polyene Metabolite from the Myxobacterium Zeitschrift fur Naturforschung B: Journal of Chemical Sciences 2003 58 (10) 1024-1026. | ||
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DOI | 10.1515/znb-2003-1015 | PMID | - |