Lamprolobine
PubChem CID: 87752
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Lamprolobine, 18688-40-9, Lamprolobin, 1-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]piperidine-2,6-dione, DTXSID00171946, (1R-cis)-1-((Octahydro-2H-quinolizin-1-yl)methyl)-2,6-piperidinedione, 1-(((1R,9aR)-octahydro-2H-quinolizin-1-yl)methyl)piperidine-2,6-dione, AC1L3EBU, AC1Q6FAJ, 2,6-Piperidinedione, 1-((octahydro-2H-quinolizin-1-yl)methyl)-, (1R-cis)-, 1-(((1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl)methyl)piperidine-2,6-dione, SureCN40596, SCHEMBL40596, CHEBI:6369, DTXCID6094437, 1-[[(1R,8AR)-2,3,4,5,6,7,8,8A-OCTAHYDRO-1H-QUINOLIZIN-1-YL]METHYL]PIPE RIDINE-2,6-DIONE, AKOS040752400, Q27107171 |
|---|---|
| Topological Polar Surface Area | 40.6 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 353.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | 1-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]piperidine-2,6-dione |
| Prediction Hob | 1.0 |
| Xlogp | 1.2 |
| Molecular Formula | C15H24N2O2 |
| Prediction Swissadme | 1.0 |
| Inchi Key | IFGFYNRAHYENJQ-CHWSQXEVSA-N |
| Fcsp3 | 0.8666666666666667 |
| Logs | -1.448 |
| Rotatable Bond Count | 2.0 |
| Logd | 0.932 |
| Compound Name | Lamprolobine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 264.184 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 264.184 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 264.36 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.1093373999999994 |
| Inchi | InChI=1S/C15H24N2O2/c18-14-7-3-8-15(19)17(14)11-12-5-4-10-16-9-2-1-6-13(12)16/h12-13H,1-11H2/t12-,13-/m1/s1 |
| Smiles | C1CCN2CCC[C@@H]([C@H]2C1)CN3C(=O)CCCC3=O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Sophora Flavescens (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Sophora Tonkinensis (Plant) Rel Props:Source_db:cmaup_ingredients