OHN
Summary
| Name: | N-3-OXO-DODECANOYL-L-HOMOSERINE LACTONE |
| Formula: | C16 H27 N O4 |
| Formal charge: | 0 |
| Formula weight: | 297.39 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-oxo-N-[(3S)-2-oxotetrahydrofuran-3-yl]dodecanamide |
| OpenEye OEToolkits | 1.5.0 | 3-oxo-N-[(3S)-2-oxooxolan-3-yl]dodecanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1OCCC1NC(=O)CC(=O)CCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCC(=O)CC(=O)N[C@H]1CCOC1=O |
| SMILES | CACTVS | 3.341 | CCCCCCCCCC(=O)CC(=O)N[CH]1CCOC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCC(=O)CC(=O)N[C@H]1CCOC1=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCC(=O)CC(=O)NC1CCOC1=O |
| InChI | InChI | 1.03 | InChI=1S/C16H27NO4/c1-2-3-4-5-6-7-8-9-13(18)12-15(19)17-14-10-11-21-16(14)20/h14H,2-12H2,1H3,(H,17,19)/t14-/m0/s1 |
| InChIKey | InChI | 1.03 | PHSRRHGYXQCRPU-AWEZNQCLSA-N |
