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CHEBI:83040 - epiandrosterone sulfate
| Formula | C19H30O5S |
| Net Charge | 0 |
| Average Mass | 370.511 |
| Monoisotopic Mass | 370.18140 |
| SMILES | [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)C(=O)CC[C@@]34[H])[C@@]1(C)CC[C@H](OS(=O)(=O)O)C2 |
| InChI | InChI=1S/C19H30O5S/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3,(H,21,22,23)/t12-,13-,14-,15-,16-,18-,19-/m0/s1 |
| InChIKey | ZMITXKRGXGRMKS-LUJOEAJASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (8987136) | |
| Homo sapiens (ncbitaxon:9606) | - | PubMed (1926228) |
| Roles Classification |
|---|
| Biological Roles: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| epiandrosterone sulfate (CHEBI:83040) has functional parent epiandrosterone (CHEBI:541975) |
| epiandrosterone sulfate (CHEBI:83040) has parent hydride 5α-androstane (CHEBI:28859) |
| epiandrosterone sulfate (CHEBI:83040) has role human metabolite (CHEBI:77746) |
| epiandrosterone sulfate (CHEBI:83040) has role mouse metabolite (CHEBI:75771) |
| epiandrosterone sulfate (CHEBI:83040) is a 17-oxo steroid (CHEBI:19168) |
| epiandrosterone sulfate (CHEBI:83040) is a androstanoid (CHEBI:50402) |
| epiandrosterone sulfate (CHEBI:83040) is a steroid sulfate (CHEBI:16158) |
| epiandrosterone sulfate (CHEBI:83040) is conjugate acid of epiandrosterone sulfate(1−) (CHEBI:133729) |
| Incoming Relation(s) |
| epiandrosterone sulfate(1−) (CHEBI:133729) is conjugate base of epiandrosterone sulfate (CHEBI:83040) |
| IUPAC Name |
|---|
| 17-oxo-5α-androstan-3β-yl hydrogen sulfate |
| Synonym | Source |
|---|---|
| (3β,5α)-17-oxoandrostan-3-yl hydrogen sulfate | IUPAC |
| Registry Numbers | Sources |
|---|---|
| Reaxys:2225705 | Reaxys |
| Citations |
|---|