Z,Z,Z-4,6,9-Nonadecatriene
PubChem CID: 5362863
Connections displayed (default: 10).
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| Compound Synonyms | Z,Z,Z-4,6,9-Nonadecatriene, NGBDUKKBGSGZKF-FVRZMWRVSA-N, DTXSID901016215, (4Z,6Z,9Z)-4,6,9-Nonadecatriene, 874302-34-8, (4Z,6Z,9Z)-4,6,9-Nonadecatriene # |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 232.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (4Z,6Z,9Z)-nonadeca-4,6,9-triene |
| Prediction Hob | 1.0 |
| Xlogp | 8.4 |
| Molecular Formula | C19H34 |
| Prediction Swissadme | 0.0 |
| Inchi Key | NGBDUKKBGSGZKF-FVRZMWRVSA-N |
| Fcsp3 | 0.6842105263157895 |
| Logs | -4.624 |
| Rotatable Bond Count | 13.0 |
| Logd | 5.029 |
| Compound Name | Z,Z,Z-4,6,9-Nonadecatriene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 262.266 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 262.266 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 262.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 3.0 |
| Esol | -5.932882199999998 |
| Inchi | InChI=1S/C19H34/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h7,9,11,13,17,19H,3-6,8,10,12,14-16,18H2,1-2H3/b9-7-,13-11-,19-17- |
| Smiles | CCCCCCCCC/C=C\C/C=C\C=C/CCC |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 3.0 |
- 1. Outgoing r'ship
FOUND_INto/from Citrus Reticulata (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Citrus Unshiu (Plant) Rel Props:Source_db:cmaup_ingredients