| Compound | 1-alpha,2-alpha,9-beta-Tri-(beta-)furoyloxy-4-beta-hydroxy-15-acetoxy-beta-dihydroagarofuran |
| NPACT-Id | NPACT01440 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| Class | Terpenoids |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | BFVLFBBCHZATDA-HYFKCHKLSA-N |
| InChi | 1S/C32H34O13/c1-18(33)41-17-31-24(43-26(34)19-9-12-38-16-19)13-20-14-32(31,45-29(20,2)3)30(4,37)15-23(42-27(35)21-7-5-10-39-21)25(31)44-28(36)22-8-6-11-40-22/h5-12,16,20,23-25,37H,13-15,17H2,1-4H3/t20-,23+,24+,25+,30+,31-,32+/m1/s1 |
| SMILES | [C@@H]1([C@H]([CH][C@@]([C@]23[C@@]1([C@H](C[C@H]([CH]2)C(C)(O3)C)OC(=O)c1ccoc1)COC(=O)C)(O)C)OC(=O)c1occc1)OC(=O)c1occc1 |
|
SMART | [H]C1[C@H]2C[C@H](OC(=O)C3=COC=C3)[C@]3(COC([#6])=O)[C@@H](OC(=O)C4=CC=CO4)[C@@H](OC(=O)C4=CC=CO4)C([H])[C@]([#6])(O)[C@@]13O[C@@]2([#6])[#6] |
| CAS No. | - |
|
Structure
Download | 
|
| 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 |