Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0TV0V
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| Former ID |
DIB018054
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| Drug Name |
(-)-alpha-thujone
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| Synonyms |
alpha-thujone
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL
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| Formula |
C10H16O
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| Canonical SMILES |
CC1C2CC2(CC1=O)C(C)C
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| InChI |
1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1
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| InChIKey |
USMNOWBWPHYOEA-MRTMQBJTSA-N
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| CAS Number |
CAS 546-80-5
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| PubChem Compound ID | ||||
| PubChem Substance ID |
12092, 9404247, 16093344, 17389182, 24889199, 26757779, 29204618, 41282903, 48422847, 48424822, 49718205, 49742701, 49856241, 50054687, 57400766, 57653336, 74382215, 80471071, 104473174, 117365398, 124890909, 125230945, 134977422, 135146795, 135956753, 137001279, 140604100, 144208066, 144212157, 162246622, 178102006, 179316511, 198940729, 198942384, 223673479, 223719956, 226493740, 241094742, 242248897
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| ChEBI ID |
CHEBI:9577
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| 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: 5344). | |||
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