| Compound | alpha-Spinasterol |
| NPACT-Id | NPACT00239 |
| IUPAC | 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol |
| Synonyms | - |
| PubChem Id | - |
| Class | Steroids |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | UEWMGQVBSUKDSE-XWUHYQCMSA-N |
| InChi | 1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,9,11,19-20,22-23,25-27,30H,1,8,10,12-18H2,2-6H3/b21-9+/t20-,22+,23+,25-,26+,27+,28+,29-/m1/s1 |
| SMILES | C1C[C@@H](C[C@H]2[C@]1([C@@H]1C(=CC2)[C@@H]2CC[C@@H]([C@]2(CC1)C)[C@@H](C/C=C(/C(C)C)C=C)C)C)O |
|
SMART | C=CC(=C/C[C@@H]([#6])[C@H]1CC[C@@]2([H])C3=CC[C@@]4([H])C[C@@H](O)CC[C@]4([#6])[C@@]3([H])CC[C@]12[#6])[C@H]([#6])[#6] |
| CAS No. | 4651-46-1 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C031312 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | No |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |