| Compound | Alvaradoins H |
| NPACT-Id | NPACT00249 |
| IUPAC | [(2R,3R,4R,5R,6S)-2-acetyloxy-3,5-dihydroxy-6-[(9R)-4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl]oxan-4-yl]3-methylbut-2-enoate |
| Synonyms | - |
| PubChem Id | 16736265 |
| Class | Polycyclic aromatic natural products |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | NVWRUTJMHZBGQX-VJXMHWMPSA-N |
| InChi | 1S/C27H28O10/c1-11(2)8-18(31)36-26-23(33)25(37-27(24(26)34)35-13(4)28)19-14-6-5-7-16(29)20(14)22(32)21-15(19)9-12(3)10-17(21)30/h5-10,19,23-27,29-30,33-34H,1-4H3/t19-,23-,24+,25-,26+,27+/m0/s1 |
| SMILES | O1[C@@H]([C@@H]2c3c(C(=O)c4c2cccc4O)c(O)cc(c3)C)[C@H](O)[C@@H](OC(=O)C=C(C)C)[C@@H](O)[C@@H]1OC(=O)C |
|
SMART | [H]OC1=C([H])C([H])=C([H])C2=C1C(=O)C1=C(O[H])C([H])=C(C([H])=C1[C@@]2([H])[C@]1([H])O[C@@]([H])(OC(=O)C([H])([H])[H])[C@]([H])(O[H])[C@]([H])(OC(=O)C([H])=C(/C([H])([H])[H])C([H])([H])[H])[C@@]1([H])O[H])C([H])([H])[H] |
| 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 | No |
| Ghose filter | No |
| Veber filter | No |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |