FTT
Summary
Name: | 3-HYDROXY-TETRADECANOIC ACID |
Synonyms: | 3-HYDROXY-MYRISTIC ACID |
Formula: | C14 H28 O3 |
Formal charge: | 0 |
Formula weight: | 244.37 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (3R)-3-hydroxytetradecanoic acid |
OpenEye OEToolkits | 1.7.6 | (3R)-3-oxidanyltetradecanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CC(O)CCCCCCCCCCC |
InChI | InChI | 1.03 | InChI=1S/C14H28O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h13,15H,2-12H2,1H3,(H,16,17)/t13-/m1/s1 |
InChIKey | InChI | 1.03 | ATRNZOYKSNPPBF-CYBMUJFWSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCCC[C@@H](O)CC(O)=O |
SMILES | CACTVS | 3.370 | CCCCCCCCCCC[CH](O)CC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCCC[C@H](CC(=O)O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCCCC(CC(=O)O)O |