Dodeca-2,4-dienamide
PubChem CID: 57265506
Connections displayed (default: 10).
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| Topological Polar Surface Area | 43.1 |
|---|---|
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 14.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 194.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | dodeca-2,4-dienamide |
| Prediction Hob | 1.0 |
| Xlogp | 3.7 |
| Molecular Formula | C12H21NO |
| Prediction Swissadme | 1.0 |
| Inchi Key | ZJDVIVOFURPUPP-UHFFFAOYSA-N |
| Fcsp3 | 0.5833333333333334 |
| Logs | -2.64 |
| Rotatable Bond Count | 8.0 |
| Logd | 2.316 |
| Compound Name | Dodeca-2,4-dienamide |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 195.162 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 195.162 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 195.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 2.0 |
| Esol | -3.3515972 |
| Inchi | InChI=1S/C12H21NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h8-11H,2-7H2,1H3,(H2,13,14) |
| Smiles | CCCCCCCC=CC=CC(=O)N |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Acanthosyris Paulo-Alvinii (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Aglaia Perviridis (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Ardisia Japonica (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Betula Alnoides (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Oocystis Polymorpha (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Phoebe Grandis (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Piper Sarmentosum (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Rubus Pileatus (Plant) Rel Props:Source_db:cmaup_ingredients