| Compound | Clerodane diterpenoid |
| NPACT-Id | NPACT00434 |
| IUPAC | [(3aR,4S,10Z,11aR)-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl]3,4-dihydroxy-2-methylidenebutanoate |
| Synonyms | - |
| PubChem Id | 11723436 |
| 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 | LVSCWEDTMWAASP-BFHBFEDWSA-N |
| InChi | 1S/C20H30O3/c1-13-6-5-7-16-19(13,3)10-8-14(2)20(16,4)11-9-15-12-17(21)23-18(15)22/h6,12,14,16,18,22H,5,7-11H2,1-4H3/t14-,16?,18+,19+,20+/m1/s1 |
| SMILES | O1[C@H](O)C(=CC1=O)CC[C@@]1([C@@H]2[C@@](CC[C@H]1C)(C(=CCC2)C)C)C |
|
SMART | [#6][C@@H]1CC[C@]2([#6])[C@H](CCC=C2[#6])[C@@]1([#6])CCC1=CC(=O)O[C@@H]1O |
| 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 |