Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00000001699 | Gold | 1 |
CCMSLIB00000001700 | Gold | 1 |
COMPOUND NPA018007
PROPERTIES
NPAID | NPA018007 |
---|---|
CLUSTER ID | 582 |
NODE ID | 518 |
NAME | Tumonoic acid G |
FORMULA | C25H43NO7 |
MOLECULAR WEIGHT (Da) | 469.6190 |
ACCURATE MASS (Da) | 469.3040 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Blennothrix |
ORIGIN SPECIES | cantharidosmum |
InChIKey | NHPBYMFQSUHYPK-UQVNRYHBSA-N |
InChI | InChI=1S/C25H43NO7/c1-6-8-9-10-11-12-14-18(4)22(27)26-16-13-15-20(26)24(30)33-21(17(3)7-2)25(31)32-19(5)23(28)29/h17-21H,6-16H2,1-5H3,(H,28,29)/t17-,18-,19-,20-,21+/m0/s1 |
SMILES | CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]1C(=O)O[C@H]([C@@H](C)CC)C(=O)O[C@@H](C)C(=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Clark, Benjamin R.; Engene, Niclas; Teasdale, Margaret E.; Rowley, David C.; Matainaho, Teatulohi; Valeriote, Frederick A.; Gerwick, William H. Natural products chemistry and taxonomy of the marine cyanobacterium Blennothrix cantharidosmum Journal of Natural Products 2008 71 (9) 1530-1537. | ||
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DOI | 10.1021/np800088a | PMID | 18698821 |