Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00000001549 | Gold | 1 |
COMPOUND NPA000789
PROPERTIES
NPAID | NPA000789 |
---|---|
CLUSTER ID | 562 |
NODE ID | 501 |
NAME | 8-epi-Malyngamide C |
FORMULA | C24H38ClNO5 |
MOLECULAR WEIGHT (Da) | 456.0230 |
ACCURATE MASS (Da) | 455.2439 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Lyngbya |
ORIGIN SPECIES | majuscula |
InChIKey | WXDBUBIFYCCNLE-FTWIAXFRSA-N |
InChI | InChI=1S/C24H38ClNO5/c1-3-4-5-6-8-11-19(30-2)12-9-7-10-13-22(29)26-17-18(16-25)24-21(28)15-14-20(27)23(24)31-24/h7,9,16,19-20,23,27H,3-6,8,10-15,17H2,1-2H3,(H,26,29)/b9-7+,18-16-/t19-,20+,23-,24+/m0/s1 |
SMILES | CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)/[C@@]12[C@@H](O1)[C@@H](CCC2=O)O)OC |
ORIGINAL ISOLATION REFERENCE
CITATION | Kwan, Jason C.; Teplitski, Max; Gunasekera, Sarath P.; Paul, Valerie J.; Luesch, Hendrik Isolation and Biological Evaluation of 8-epi-Malyngamide C from the Floridian Marine Cyanobacterium Lyngbya majuscula† Journal of Natural Products 2010 73 (3) 463-466. | ||
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DOI | 10.1021/np900614n | PMID | 20166701 |