| Compound | alpha-cadinol |
| NPACT-Id | NPACT01121 |
| IUPAC | - |
| Synonyms | .delta.-Cadinol;.tau.-Muurolol;.tau.-Cadinol;1.beta.-Cadin-4-en-10-ol;4-Isopropyl-1,6-dimethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenol;1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, [1R-(1.alpha.,4.beta.,4a.beta.,8a.beta.)]-; |
| PubChem Id | 519662 |
| Class | Terpenoids |
| In-vitro anticancer activity | 4 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | NQO1 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | LHYHMMRYTDARSZ-UHFFFAOYSA-N |
| InChi | 1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3 |
| SMILES | OC1(C2C(C(CC1)C(C)C)C=C(CC2)C)C |
|
SMART | [H]O[C@@]1(C([H])([H])[H])C([H])([H])C([H])([H])[C@]([H])([C@]([H])(C([H])([H])[H])C([H])([H])[H])[C@@]2([H])C([H])=C(C([H])([H])[H])C([H])([H])C([H])([H])[C@]12[H] |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C445364 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, ChemFrog, |
| Drug-Likeliness Filters | Lipinski's rule of five | Yes |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |