EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C30H44O10 |
| Net Charge | 0 |
| Average Mass | 564.672 |
| Monoisotopic Mass | 564.29345 |
| SMILES | [H][C@]12CC[C@@]3(C)[C@](O)(C[C@H](O)[C@]3([H])C3=CC(=O)OC3)[C@]1([H])CC[C@]1(O)C[C@@H](O[C@H]3C[C@@H](OC)[C@@H](O)[C@@H](C)O3)CC[C@@]12C=O |
| InChI | InChI=1S/C30H44O10/c1-16-26(34)22(37-3)11-24(39-16)40-18-4-8-28(15-31)19-5-7-27(2)25(17-10-23(33)38-14-17)21(32)13-30(27,36)20(19)6-9-29(28,35)12-18/h10,15-16,18-22,24-26,32,34-36H,4-9,11-14H2,1-3H3/t16-,18+,19+,20-,21+,22-,24+,25+,26+,27-,28+,29+,30+/m1/s1 |
| InChIKey | NAQIOLFTZRJOKV-OBDZMSMTSA-N |
| Roles Classification |
|---|
| Application: | cardioprotective agent Any protective agent that is able to prevent damage to the heart. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Vernadigin (CHEBI:9958) is a cardenolide glycoside (CHEBI:38092) |
| Synonyms | Source |
|---|---|
| Strophadogenin 3-O-beta-D-diginoside | KEGG COMPOUND |
| Vernadigin | KEGG COMPOUND |