cis,cis-7,10,-Hexadecadienal
PubChem CID: 5365665
Connections displayed (default: 10).
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| Compound Synonyms | cis,cis-7,10,-Hexadecadienal, DTXSID60880840, 56829-23-3, SCHEMBL10613675, DTXCID801022192, (7Z,10Z)-7,10-Hexadecadienal, (7Z,10Z)-7,10-Hexadecadienal #, NS00096178 |
|---|---|
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 17.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 204.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (7Z,10Z)-hexadeca-7,10-dienal |
| Prediction Hob | 1.0 |
| Xlogp | 5.4 |
| Molecular Formula | C16H28O |
| Prediction Swissadme | 0.0 |
| Inchi Key | WIWVOAOSGQCJSL-HZJYTTRNSA-N |
| Fcsp3 | 0.6875 |
| Logs | -3.346 |
| Rotatable Bond Count | 12.0 |
| Logd | 3.609 |
| Compound Name | cis,cis-7,10,-Hexadecadienal |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 236.214 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 236.214 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 236.39 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 2.0 |
| Esol | -3.934573799999999 |
| Inchi | InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h6-7,9-10,16H,2-5,8,11-15H2,1H3/b7-6-,10-9- |
| Smiles | CCCCC/C=C\C/C=C\CCCCCC=O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 2.0 |
- 1. Outgoing r'ship
FOUND_INto/from Uncaria Macrophylla (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all