Tetracosanoate
PubChem CID: 5461021
Connections displayed (default: 10).
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| Compound Synonyms | tetracosanoate, lignocerate, tetracosanate, tetracosoate, Lignocerat, Tetracosanoat, tetraeicosanoate, n-tetracosanoate, 46927-71-3, CHEBI:31014, DTXSID80420121, CH3-[CH2]22-COO(-), CH3-(CH2)22-COO(-), DTXCID10370968, Q27114066 |
|---|---|
| Topological Polar Surface Area | 40.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 26.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 270.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | tetracosanoate |
| Prediction Hob | 0.0 |
| Xlogp | 11.3 |
| Molecular Formula | C24H47O2- |
| Prediction Swissadme | 0.0 |
| Inchi Key | QZZGJDVWLFXDLK-UHFFFAOYSA-M |
| Fcsp3 | 0.9583333333333334 |
| Logs | -6.754 |
| Rotatable Bond Count | 21.0 |
| Logd | 3.859 |
| Compound Name | Tetracosanoate |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 367.358 |
| Formal Charge | -1.0 |
| Monoisotopic Mass | 367.358 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 367.6 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -8.788055600000002 |
| Inchi | InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)/p-1 |
| Smiles | CCCCCCCCCCCCCCCCCCCCCCCC(=O)[O-] |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Changium Smyrnioides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Cnidium Monnieri (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Ligusticum Sinense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Nelumbo Nucifera (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Oplopanax Elatus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Potentilla Discolor (Plant) Rel Props:Source_db:npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Saposhnikovia Divaricata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Schizonepeta Tenuifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Terminalia Chebula (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 10. Outgoing r'ship
FOUND_INto/from Ziziphus Jujuba (Plant) Rel Props:Source_db:cmaup_ingredients