Bioactive Compound Details
| BioID | bio199762 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL450299 |
| Molecular Formula | C34H42N2O4 |
| Molecular Weight | 542.72 |
| Molecular Weight (Monoisotopic) | 542.3145 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Methyl 12,14-Bis[(2-Methoxyphenyl)Amino]Dehydroabietate |
| Smiles | COc1ccccc1Nc1cc2c(c(Nc3ccccc3OC)c1C(C)C)C[C@@H]1[C@](C)(CCC[C@@]1(C)C(=O)O)C2 |
| Inchi | InChI=1S/C34H42N2O4/c1-21(2)30-26(35-24-12-7-9-14-27(24)39-5)18-22-20-33(3)16-11-17-34(4,32(37)38)29(33)19-23(22)31(30)36-25-13-8-10-15-28(25)40-6/h7-10,12-15,18,21,29,35-36H,11,16-17,19-20H2,1-6H3,(H,37,38)/t29-,33-,34-/m1/s1 |
| Inchi Key | UJZQLNJODHOZRA-QVLFBZODSA-N |
| Molecular Species | ACID |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 1.14 |
| Records Key | ['15'] |
| Records Name | ['Methyl 12,14-Bis[(2-methoxyphenyl)amino]dehydroabietate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
