EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:27771 - 16α-hydroxydehydroepiandrosterone
| Formula | C19H28O3 |
| Net Charge | 0 |
| Average Mass | 304.430 |
| Monoisotopic Mass | 304.20384 |
| SMILES | [H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=O)[C@H](O)C[C@@]21[H] |
| InChI | InChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-16,20-21H,4-10H2,1-2H3/t12-,13+,14-,15-,16+,18-,19-/m0/s1 |
| InChIKey | QQIVKFZWLZJXJT-DNKQKWOHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | - | DOI (10.1038/nbt.2488) | |
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| Roles Classification |
|---|
| Biological Roles: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) has role human metabolite (CHEBI:77746) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) has role mouse metabolite (CHEBI:75771) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) is a 16α-hydroxy steroid (CHEBI:16799) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) is a 17-oxo steroid (CHEBI:19168) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) is a androstanoid (CHEBI:50402) |
| 16α-hydroxydehydroepiandrosterone (CHEBI:27771) is a secondary α-hydroxy ketone (CHEBI:2468) |
| IUPAC Name |
|---|
| 3β,16α-dihydroxyandrost-5-en-17-one |
| Synonyms | Source |
|---|---|
| 16alpha-Hydroxydehydroepiandrosterone | KEGG COMPOUND |
| 5-Androstene-3beta,16alpha-diol-17-one | KEGG COMPOUND |
| 16alpha-Hydroxydehydroisoandrosterone | ChemIDplus |
| UniProt Name | Source |
|---|---|
| 3β,16α-dihydroxy-androst-5-en-17-one | UniProt |
| Manual Xrefs | Databases |
|---|---|
| C05139 | KEGG COMPOUND |
| LMST02020064 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| Beilstein:2625823 | Beilstein |
| CAS:1232-73-1 | KEGG COMPOUND |
| CAS:1232-73-1 | ChemIDplus |