| Compound | 3-alpha-Amino-14-beta-hydroxypregnan-20-one |
| NPACT-Id | NPACT01482 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| Class | Alkaloids |
| In-vitro anticancer activity | 2 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | XJVNAZVHBATLOY-QLQRKERMSA-N |
| InChi | 1S/C21H35NO2/c1-13(23)16-8-11-21(24)18-5-4-14-12-15(22)6-9-19(14,2)17(18)7-10-20(16,21)3/h14-18,24H,4-12,22H2,1-3H3/t14-,15-,16?,17-,18+,19-,20+,21-/m0/s1 |
| SMILES | C1C[C@@H](C[C@H]2[C@]1([C@@H]1[C@@H](CC2)[C@@]2([C@](CC1)(C(CC2)C(=O)C)C)O)C)N |
|
SMART | [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4([#6])C(CC[C@]34O)C([#6])=O)[C@@]1([#6])CC[C@H]([#7])C2 |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| 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 |