BFC
Summary
Name: | (R)-3-HYDROXYTETRADECANAL |
Formula: | C14 H28 O2 |
Formal charge: | 0 |
Formula weight: | 228.371 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (3R)-3-hydroxytetradecanal |
OpenEye OEToolkits | 1.5.0 | (3R)-3-hydroxytetradecanal |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=CCC(O)CCCCCCCCCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCC[C@@H](O)CC=O |
SMILES | CACTVS | 3.341 | CCCCCCCCCCC[CH](O)CC=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCC[C@H](CC=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCC(CC=O)O |
InChI | InChI | 1.03 | InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-14(16)12-13-15/h13-14,16H,2-12H2,1H3/t14-/m1/s1 |
InChIKey | InChI | 1.03 | PCOHAOZBEIUVSX-CQSZACIVSA-N |