HTF
Summary
| Name: | N-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDE |
| Synonyms: | N-OCTANOYL-L-HOMOSERINE LACTONE |
| Formula: | C12 H21 N O3 |
| Formal charge: | 0 |
| Formula weight: | 227.3 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-[(3S)-2-oxotetrahydrofuran-3-yl]octanamide |
| OpenEye OEToolkits | 1.5.0 | N-[(3S)-2-oxooxolan-3-yl]octanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1OCCC1NC(=O)CCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCC(=O)N[C@H]1CCOC1=O |
| SMILES | CACTVS | 3.341 | CCCCCCCC(=O)N[CH]1CCOC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCC(=O)N[C@H]1CCOC1=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCC(=O)NC1CCOC1=O |
| InChI | InChI | 1.03 | InChI=1S/C12H21NO3/c1-2-3-4-5-6-7-11(14)13-10-8-9-16-12(10)15/h10H,2-9H2,1H3,(H,13,14)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | JKEJEOJPJVRHMQ-JTQLQIEISA-N |
