| Compound | Machilin G |
| NPACT-Id | NPACT00736 |
| IUPAC | 5-[(2S,3S,4R,5R)-5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]-1,3-benzodioxole |
| Synonyms | - |
| PubChem Id | 10450921 |
| Class | Lignans |
| In-vitro anticancer activity | 3 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | PLCG1 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | HSMDOSKNXLVXIP-QVEMZERUSA-N |
| InChi | 1S/C21H24O5/c1-12-13(2)21(15-6-8-17-19(10-15)25-11-24-17)26-20(12)14-5-7-16(22-3)18(9-14)23-4/h5-10,12-13,20-21H,11H2,1-4H3/t12-,13+,20-,21+/m1/s1 |
| SMILES | O1[C@@H]([C@H]([C@H]([C@@H]1c1cc(OC)c(OC)cc1)C)C)c1cc2OCOc2cc1 |
|
SMART | [#6]OC1=C(O[#6])C=C(C=C1)[C@@H]1O[C@@H]([C@@H]([#6])[C@H]1[#6])C1=CC2=C(OCO2)C=C1 |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ZINC, |
| 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 |