| Compound | Coriaheptocin B |
| NPACT-Id | NPACT00439 |
| IUPAC | (1S,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid |
| Synonyms | - |
| PubChem Id | 44566649 |
| Class | Polyketides |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | LHVHDMHDABWGLD-PBUIZIMXSA-N |
| InChi | 1S/C35H64O10/c1-3-4-5-6-7-8-9-10-11-12-13-29(39)30(40)16-14-27(37)22-28(38)23-32(42)34-19-18-33(45-34)31(41)17-15-26(36)21-25-20-24(2)44-35(25)43/h20,24,26-34,36-42H,3-19,21-23H2,1-2H3/t24-,26+,27-,28+,29+,30+,31+,32-,33+,34-/m0/s1 |
| SMILES | O1[C@@H](CC[C@@H]1[C@H](O)CC[C@@H](O)CC1=C[C@@H](OC1=O)C)[C@@H](O)C[C@H](O)C[C@@H](O)CC[C@@H](O)[C@H](O)CCCCCCCCCCCC |
|
SMART | [#6]CCCCCCCCCCC[C@@H](O)[C@H](O)CC[C@H](O)C[C@@H](O)C[C@H](O)[C@@H]1CC[C@@H](O1)[C@H](O)CC[C@@H](O)CC1=C[C@H]([#6])OC1=O |
| 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 |