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CHEBI:182763 - Rhodotoxine
| Formula | C22H36O7 |
| Net Charge | 0 |
| Average Mass | 412.523 |
| Monoisotopic Mass | 412.24610 |
| SMILES | [H][C@@]12C[C@H](O)C(C)(C)[C@@]1(O)[C@@H](O)C[C@]13C[C@@](C)(O)[C@]([H])(CC[C@@]1([H])[C@@]2(C)O)[C@@H]3OC(C)=O |
| InChI | InChI=1S/C22H36O7/c1-11(23)29-17-12-6-7-13-20(5,27)14-8-15(24)18(2,3)22(14,28)16(25)9-21(13,17)10-19(12,4)26/h12-17,24-28H,6-10H2,1-5H3/t12-,13+,14+,15+,16+,17+,19-,20-,21+,22+/m1/s1 |
| InChIKey | NXCYBYJXCJWMRY-AEAYXKAASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Rhodotoxine (CHEBI:182763) is a diterpenoid (CHEBI:23849) |
| IUPAC Name |
|---|
| [(1S,3R,4R,6S,8S,9R,10R,13R,14R,16S)-3,4,6,9,14-pentahydroxy-5,5,9,14-tetramethyl-16-tetracyclo[11.2.1.01,10.04,8]hexadecanyl] acetate |