Tsuzuic acid
PubChem CID: 5312399
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| Compound Synonyms | Tsuzuic acid, 4Z-tetradecenoic acid, cis-4-Tetradecenoic acid, (Z)-4-Tetradecenoic acid, 63KG6H8BKZ, 4-Tetradecenoic acid, (Z)-, Tetradec-4-enoic acid, (Z)-, Tsuduic acid, (Z)-tetradec-4-enoic acid, UNII-63KG6H8BKZ, C14:1n-10, 14:1(N-10), 7089-44-3, Tsuzuate, Tuduic acid, 4-tetradecenoate, SCHEMBL371562, CHEBI:171746, LMFA01030247 |
|---|---|
| Topological Polar Surface Area | 37.3 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 16.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 185.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-tetradec-4-enoic acid |
| Prediction Hob | 1.0 |
| Xlogp | 5.3 |
| Molecular Formula | C14H26O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | CUVLOCDGQCUQSI-KHPPLWFESA-N |
| Fcsp3 | 0.7857142857142857 |
| Logs | -3.34 |
| Rotatable Bond Count | 11.0 |
| Logd | 2.706 |
| Compound Name | Tsuzuic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 226.193 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 226.193 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 226.35 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -3.8501319999999994 |
| Inchi | InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h10-11H,2-9,12-13H2,1H3,(H,15,16)/b11-10- |
| Smiles | CCCCCCCCC/C=C\CCC(=O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Litsea Pungens (Plant) Rel Props:Source_db:cmaup_ingredients