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CHEBI:192782 - deoxycholic acid-2,2,4,4-d4
| Formula | C24H36D4O4 |
| Net Charge | 0 |
| Average Mass | 396.604 |
| Monoisotopic Mass | 396.31777 |
| SMILES | [H][C@@]12CC[C@]3([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]3(C)[C@@]1([H])C[C@H](O)[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CCC(=O)O |
| InChI | InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1/i10D2,12D2 |
| InChIKey | KXGVEGMKQFWNSR-FCSCGBJGSA-N |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | human blood serum metabolite Any metabolite (endogenous or exogenous) found in human blood serum samples. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| deoxycholic acid-2,2,4,4-d4 (CHEBI:192782) is a deoxycholic acid (CHEBI:28834) |
| deoxycholic acid-2,2,4,4-d4 (CHEBI:192782) is a deuterated compound (CHEBI:76107) |