EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C23H36O2 |
| Net Charge | 0 |
| Average Mass | 344.539 |
| Monoisotopic Mass | 344.27153 |
| SMILES | [H][C@@]1([C@@]2([H])CC[C@]3([H])[C@]4([H])CC[C@]5([H])CCCC[C@]5(C)[C@@]4([H])CC[C@]23C)COC(=O)C1 |
| InChI | InChI=1S/C23H36O2/c1-22-11-4-3-5-16(22)6-7-17-19-9-8-18(15-13-21(24)25-14-15)23(19,2)12-10-20(17)22/h15-20H,3-14H2,1-2H3/t15-,16-,17-,18+,19+,20-,22-,23+/m0/s1 |
| InChIKey | AQARKTASOBROAE-KPSWSRIPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5β-cardanolide (CHEBI:35542) is a cardanolide (CHEBI:35543) |
| Incoming Relation(s) |
| cardanolide glycoside (CHEBI:59029) has functional parent 5β-cardanolide (CHEBI:35542) |
| strophanthidin (CHEBI:38178) has functional parent 5β-cardanolide (CHEBI:35542) |
| 3-epi-digoxigenin (CHEBI:63497) has parent hydride 5β-cardanolide (CHEBI:35542) |
| adonitoxigenin (CHEBI:46615) has parent hydride 5β-cardanolide (CHEBI:35542) |
| antiogenin (CHEBI:38405) has parent hydride 5β-cardanolide (CHEBI:35542) |
| bipindogenin (CHEBI:38243) has parent hydride 5β-cardanolide (CHEBI:35542) |
| cannogenin (CHEBI:38148) has parent hydride 5β-cardanolide (CHEBI:35542) |
| diginatigenin (CHEBI:38095) has parent hydride 5β-cardanolide (CHEBI:35542) |
| digitoxigenin (CHEBI:42219) has parent hydride 5β-cardanolide (CHEBI:35542) |
| digoxigenin (CHEBI:42098) has parent hydride 5β-cardanolide (CHEBI:35542) |
| gitoxigenin (CHEBI:38105) has parent hydride 5β-cardanolide (CHEBI:35542) |
| ouabagenin (CHEBI:71016) has parent hydride 5β-cardanolide (CHEBI:35542) |
| sarmentogenin (CHEBI:37665) has parent hydride 5β-cardanolide (CHEBI:35542) |
| sarmentologenin (CHEBI:71625) has parent hydride 5β-cardanolide (CHEBI:35542) |
| IUPAC Name |
|---|
| 5β-cardanolide |