Anodyne| Atagabalin | |
|---|---|
 | |
| Molecular structure via molpic | |
| Conformer structure via 3Dmol.js | |
| Molecular formula | C10H19NO2[1] |
| Molecular mass | 185.26 g/mol[1] |
| Predicted LogP | -1.3[1] |
| Chirality | absolute[2] |
| Identifiers [] | |
|---|---|
| IUPAC name | 2-[(3S,4S)-1-(aminomethyl)-3,4-dimethylcyclopentyl]acetic acid[1] |
| SMILES | C[C@H]1CC(C[C@@H]1C)(CC(=O)O)CN[1] |
| InChI | InChI=1S/C10H19NO2/c1-7-3-10(6-11,4-8(7)2)5-9(12)13/h7-8H,3-6,11H2,1-2H3,(H,12,13)/t7-,8-/m0/s1[1] |
| InChIKey | IUVMAUQEZFTTFB-YUMQZZPRSA-N[1] |
| Dosing |
|---|
Atagabalin
Atagabalin (also known as 2-((3S,4S)-1-(Aminomethyl)-3,4-dimethylcyclopentyl)acetic acid, (3S,4s)-1-(aminomethyl)-3,4-dimethylcyclopentyl]acetic acid, trans-dimethyl gababutin, Cyclopentaneacetic acid, 1-(aminomethyl)-3,4-dimethyl-, (3S,4S)-, Atagabalina, Atagabaline, ((3S,4S)-1-(Aminomethyl)-3,4-dimethylcyclopentyl)acetic acid, [(3S,4S)-1-(Aminomethyl)-3,4-dimethylcyclopentyl]acetic acid, DB12032 or HY-14856) is a substance of the gabapentinoid class.
Chemistry
Stereochemistry
Atagabalin is a absolute mixture