EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H43F3O2 |
| Net Charge | 0 |
| Average Mass | 456.633 |
| Monoisotopic Mass | 456.32152 |
| SMILES | [H][C@@]12CC=C3C[C@@](C)(O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC[C@](C)(O)C(F)(F)F |
| InChI | InChI=1S/C27H43F3O2/c1-17(10-13-26(5,32)27(28,29)30)20-8-9-21-19-7-6-18-16-23(2,31)14-15-24(18,3)22(19)11-12-25(20,21)4/h6,17,19-22,31-32H,7-16H2,1-5H3/t17-,19+,20-,21+,22+,23+,24+,25-,26+/m1/s1 |
| InChIKey | BVBRUQYHUXKZMQ-JNVAYQLDSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| dalzanemdor (CHEBI:758678) is a bile acid (CHEBI:3098) |
| INN | Source |
|---|---|
| dalzanemdor | WHO MedNet |
| Synonyms | Source |
|---|---|
| SAGE-718 | ChEMBL |
| SAGE718 | ChEMBL |
| Citations |
|---|