Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA001294
PROPERTIES
NPAID | NPA001294 |
---|---|
CLUSTER ID | 864 |
NODE ID | 748 |
NAME | Lobosamide A |
FORMULA | C29H41NO5 |
MOLECULAR WEIGHT (Da) | 483.6490 |
ACCURATE MASS (Da) | 483.2985 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Micromonospora |
ORIGIN SPECIES | sp. |
InChIKey | OXBKRYKWMRJSMZ-JCTAFSBOSA-N |
InChI | InChI=1S/C29H41NO5/c1-21-13-9-11-16-24(4)30-27(33)18-8-6-5-7-15-23(3)28(34)29(35)26(32)20-25(31)17-12-10-14-22(2)19-21/h5-15,17-19,23-26,28-29,31-32,34-35H,16,20H2,1-4H3,(H,30,33)/b6-5?,11-9?,14-10?,15-7?,17-12-,18-8?,21-13?,22-19?/t23-,24-,25-,26-,28+,29+/m0/s1 |
SMILES | C[C@H]1CC=CC=C(C=C(C=C/C=C\[C@@H](C[C@@H]([C@H]([C@@H]([C@H](C=CC=CC=CC(=O)N1)C)O)O)O)O)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Schulze, Christopher J.; Donia, Mohamed S.; Siqueira-Neto, Jair L.; Ray, Debalina; Raskatov, Jevgenij A.; Green, Richard E.; McKerrow, James H.; Fischbach, Michael A.; Linington, Roger G. Genome-Directed Lead Discovery: Biosynthesis, Structure Elucidation, and Biological Evaluation of Two Families of Polyene Macrolactams against Trypanosoma brucei ACS Chemical Biology 2015 10 (10) 2373-2381. | ||
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DOI | 10.1021/acschembio.5b00308 | PMID | 26270237 |