HXD
Summary
| Name: | (3R)-3-HYDROXYDODECANOIC ACID |
| Synonyms: | 3-OH-DODECANOATE |
| Formula: | C12 H24 O3 |
| Formal charge: | 0 |
| Formula weight: | 216.317 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (3R)-3-hydroxydodecanoic acid |
| OpenEye OEToolkits | 1.5.0 | (3R)-3-hydroxydodecanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CC(O)CCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCC[C@@H](O)CC(O)=O |
| SMILES | CACTVS | 3.341 | CCCCCCCCC[CH](O)CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCC[C@H](CC(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCC(CC(=O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C12H24O3/c1-2-3-4-5-6-7-8-9-11(13)10-12(14)15/h11,13H,2-10H2,1H3,(H,14,15)/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | MUCMKTPAZLSKTL-LLVKDONJSA-N |
