L-ammodendrine
PubChem CID: 7529487
Connections displayed (default: 10).
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| Compound Synonyms | L-ammodendrine, CHEMBL464776 |
|---|---|
| Topological Polar Surface Area | 32.299 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 15.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 273.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | 1-[5-[(2S)-piperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone |
| Prediction Hob | 1.0 |
| Xlogp | 0.3 |
| Molecular Formula | C12H20N2O |
| Prediction Swissadme | 1.0 |
| Inchi Key | APKLQIQRPUDADG-LBPRGKRZSA-N |
| Fcsp3 | 0.75 |
| Logs | -0.186 |
| Rotatable Bond Count | 1.0 |
| Logd | 0.68 |
| Compound Name | L-ammodendrine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 208.158 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 208.158 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 208.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.2136909999999999 |
| Inchi | InChI=1S/C12H20N2O/c1-10(15)14-8-4-5-11(9-14)12-6-2-3-7-13-12/h9,12-13H,2-8H2,1H3/t12-/m0/s1 |
| Smiles | CC(=O)N1CCCC(=C1)[C@@H]2CCCCN2 |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Lupinus Albus (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Lupinus Angustifolius (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Lupinus Corymbosus (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Lupinus Cosentinii (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Lupinus Formosus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Lupinus Holosericeus (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Lupinus Luteus (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Lupinus Micranthus (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Lupinus Mutabilis (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Lupinus Paniculatus (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Lupinus Pilosus (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Lupinus Verbasciformis (Plant) Rel Props:Reference: