Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D06UBH
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| Former ID |
DNC014751
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| Drug Name |
ALFAXALONE
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| Synonyms |
Alphaxalone; Alfaxalone; 23930-19-0; 5alpha-Pregnan-3alpha-ol-11,20-dione; GR 2/234; Alfaxalonum [INN-Latin]; Alfaxalona [INN-Spanish]; 3alpha-Hydroxy-5alpha-pregnane-11,20-dione; UNII-BD07M97B2A; BRN 3217240; MLS001076262; MLS000069684; 3alpha-Hydroxy-5alpha-pregnan-11,20-dion; BD07M97B2A; CHEMBL190279; CHEBI:34531; 3-alpha-Hydroxy-5-alpha-pregnane-11,20-dione; (3-alpha,5-alpha)-3-Hydroxypregnane-11,20-dione; alfaxolone; 3-Hydroxypregnane-11,20-dione; NCGC00023100-03; SMR000058494; (3a,5a)-3-Hydroxypregnane-11,20-dione
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C21H32O3
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| Canonical SMILES |
CC(=O)C1CCC2C1(CC(=O)C3C2CCC4C3(CCC(C4)O)C)C
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| InChI |
1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17-,19+,20-,21+/m0/s1
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| InChIKey |
DUHUCHOQIDJXAT-OLVMNOGESA-N
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| CAS Number |
CAS 23930-19-0
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| PubChem Compound ID | ||||
| PubChem Substance ID |
854048, 855840, 7978674, 10233638, 11467030, 11468150, 11486740, 12208589, 14875320, 17405487, 24278637, 44434440, 47350446, 47425382, 47425383, 47647606, 48244477, 48415536, 49699013, 50019529, 50104098, 50104099, 50104100, 51091619, 53388083, 53778035, 53787487, 56422127, 57337876, 85788083, 90341788, 91722059, 92126009, 92304100, 93167055, 103461989, 103914566, 104050286, 104373070, 121361644, 121363680, 124750106, 124801486, 127788069, 134351956, 135062356, 137156960, 140248809, 144204435, 162092653
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| ChEBI ID |
CHEBI:34531
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| SuperDrug ATC ID |
N01AX05
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Gamma-aminobutyric acid receptor (GAR) | Target Info | Inhibitor | [2] |
| 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: 5461). | |||
| REF 2 | Propofol analogues. Synthesis, relationships between structure and affinity at GABAA receptor in rat brain, and differential electrophysiological p... J Med Chem. 1998 May 21;41(11):1846-54. | |||
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