(S)-3-Hydroxymyristic acid
PubChem CID: 5312869
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | (S)-3-Hydroxymyristic acid, 35683-15-9, (S)-3-hydroxytetradecanoic acid, (3S)-3-hydroxytetradecanoic acid, (S)-3-Hydroxy Myristic Acid, (3S)-Hydroxymyristic acid, L-beta-Hydroxymyristic acid, 3S-hydroxy-tetradecanoic acid, S-3-Hydroxytetradecanoic acid, 3-Hydroxymyristic acid, (3S)-, O6ELB6TT51, 3-Hydroxymyristic acid, (+)-, Tetradecanoic acid, 3-hydroxy-, (S)-, Tetradecanoic acid, 3-hydroxy-, (3S)-, starbld0001760, UNII-O6ELB6TT51, (3S)-3-hydroxymyristic acid, (S)-beta-Hydroxymyristic acid, SCHEMBL2306670, CHEBI:37374, ATRNZOYKSNPPBF-ZDUSSCGKSA-N, DTXSID701307151, LMFA01050323, L-.BETA.-HYDROXYMYRISTIC ACID, C14:0 3(S)-OH, AT40459, C14:0 3-OH, HY-W698462, (S)-.BETA.-HYDROXYMYRISTIC ACID, BP-29867, DB-224801, 14:0(3-OH), Q27117123 |
|---|---|
| Topological Polar Surface Area | 57.5 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 17.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 180.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (3S)-3-hydroxytetradecanoic acid |
| Prediction Hob | 1.0 |
| Xlogp | 4.7 |
| Molecular Formula | C14H28O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ATRNZOYKSNPPBF-ZDUSSCGKSA-N |
| Fcsp3 | 0.9285714285714286 |
| Logs | -3.464 |
| Rotatable Bond Count | 12.0 |
| Logd | 2.369 |
| Compound Name | (S)-3-Hydroxymyristic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 244.204 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 244.204 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 244.37 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.517825 |
| Inchi | 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-/m0/s1 |
| Smiles | CCCCCCCCCCC[C@@H](CC(=O)O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Hypericum Perforatum (Plant) Rel Props:Source_db:cmaup_ingredients