Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D08XML
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| Former ID |
DIB018853
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| Drug Name |
androstenol
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| Synonyms |
5alpha-Androst-16-en-3alpha-ol; Androstenol; 1153-51-1; Androst-16-en-3alpha-ol; 16,17-ANDROSTENE-3-OL; Androst-16-en-3-ol; 3alpha-Hydroxyandrost-16-ene; alpha-androstenol; UNII-48K9VAM062; (3alpha,5alpha)-Androst-16-en-3-ol; Androst-16-en-3-ol, (3alpha,5alpha)-; CHEMBL142348; CHEBI:40933; KRVXMNNRSSQZJP-PHFHYRSDSA-N; 48K9VAM062; Androst-16-en-3-ol, (3a,5a)-; androst-16-en-3-ol; 16,17-Androstene-3-Ol
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1], [2] | |
| Structure |
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Download2D MOL |
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| Formula |
C19H30O
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| Canonical SMILES |
CC12CCC3C(C1CC=C2)CCC4C3(CCC(C4)O)C
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| InChI |
1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h3,9,13-17,20H,4-8,10-12H2,1-2H3/t13-,14+,15-,16-,17-,18-,19-/m0/s1
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| InChIKey |
KRVXMNNRSSQZJP-PHFHYRSDSA-N
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| CAS Number |
CAS 1153-51-1
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| PubChem Compound ID | ||||
| PubChem Substance ID |
114204, 7885991, 10232356, 12352899, 15222023, 24702268, 24908740, 26697297, 44431942, 46505452, 48258929, 50076533, 57337556, 78146511, 103384231, 104025255, 104365696, 126525555, 128425701, 135143040, 135651439, 137131413, 139582145, 139582152, 144087422, 160965114, 163304781, 177749030, 179323900, 184564670, 198980400, 208012008, 212343003, 224968317, 226662294, 250108906, 252342008
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| ChEBI ID |
CHEBI:40933
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Orphan nuclear receptor NR1I3 (NR1I3) | Target Info | Antagonist | [2], [3] |
| Pathway Interaction Database | Glucocorticoid receptor regulatory network | |||
| WikiPathways | Nuclear Receptors in Lipid Metabolism and Toxicity | |||
| Nuclear Receptors Meta-Pathway | ||||
| Constitutive Androstane Receptor Pathway | ||||
| Drug Induction of Bile Acid Pathway | ||||
| Nuclear Receptors | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 2761). | |||
| REF 2 | The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. | |||
| REF 3 | Androstane metabolites bind to and deactivate the nuclear receptor CAR-beta. Nature. 1998 Oct 8;395(6702):612-5. | |||
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