Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027229
PROPERTIES
| NPAID | NPA027229 |
|---|---|
| CLUSTER ID | 8239 |
| NODE ID | 5595 |
| NAME | Decarbamoylgonyautoxin-3 |
| FORMULA | C9H16N6O7S |
| MOLECULAR WEIGHT (Da) | 352.3290 |
| ACCURATE MASS (Da) | 352.0801 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | wollei |
| InChIKey | AJLCXXKDNUGKKH-RGDLXGNYSA-N |
| InChI | InChI=1S/C9H16N6O7S/c10-6-13-5-3(2-16)12-7(11)15-1-4(22-23(19,20)21)9(17,18)8(5,15)14-6/h3-5,16-18H,1-2H2,(H2,11,12)(H3,10,13,14)(H,19,20,21)/t3-,4-,5-,8-/m0/s1 |
| SMILES | NC1=N[C@H]2[C@H](CO)N=C(N)N3C[C@H](OS(=O)(=O)O)C(O)(O)[C@]23N1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Onodera H; Satake M; Oshima Y; Yasumoto T; Carmichael WW New saxitoxin analogues from the freshwater filamentous cyanobacterium Lyngbya wollei. Natural Toxins 1997 5 (4) 146-151. | ||
|---|---|---|---|
| DOI | 10.1002/1522-7189(1997)5:4<146::AID-NT4>3.0.CO;2-V | PMID | 9407557 |
