| Compound | Uncarinic acid A |
| NPACT-Id | NPACT00996 |
| IUPAC | 3-beta-hydroxy-27-E-feruloyloxyolea-12-en-28-oic acid |
| Synonyms | - |
| PubChem Id | 5274626 |
| Class | Terpenoids |
| In-vitro anticancer activity | 5 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | PLCG1 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | JRPVAEQMQZMGNM-YPSYTYALSA-N |
| InChi | 1S/C38H52O6/c1-33(2)17-18-37(32(43)44)19-20-38(31(42)12-8-23-7-10-26(39)27(40)21-23)24(25(37)22-33)9-11-29-35(5)15-14-30(41)34(3,4)28(35)13-16-36(29,38)6/h7-10,12,21,25,28-30,39-41H,11,13-20,22H2,1-6H3,(H,43,44)/b12-8+/t25-,28?,29?,30-,35-,36+,37-,38+/m0/ |
| SMILES | O[C@@H]1C([C@H]2[C@@]([C@H]3[C@]([C@]4(C(=CC3)[C@H]3[C@@](CC4)(CCC(C3)(C)C)C(=O)O)C(=O)/C=C/c3cc(O)c(O)cc3)(CC2)C)(CC1)C)(C)C |
|
SMART | [H]OC(=O)[C@@]12C([H])([H])C([H])([H])[C@]3(C(=O)C([H])=C(/[H])C4=C([H])C(O[H])=C(O[H])C([H])=C4[H])C(=C([H])C([H])([H])[C@@]4([H])[C@@]5(C([H])([H])[H])C([H])([H])C([H])([H])[C@]([H])(O[H])[C@@](C([H])([H])[H])(C([H])([H])[H])[C@]5([H])C([H])([H])C([H])([H])[C@@]34C([H])([H])[H])[C@]1([H])C([H])([H])[C@@](C([H])([H])[H])(C([H])([H])[H])C([H])([H])C2([H])[H] |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C120092 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | No |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |