Naloxone
AlkaPlorer ID: AK005244
Synonym: None
IUPAC Name: (4S,4aR,7aS,12bR)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Structure
SMILES: C=CCN1CC[C@@]23C4=C5C=CC(O)=C4O[C@@H]2C(=O)CC[C@]3(O)[C@@H]1C5
InChI: InChI=1S/C19H21NO4/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11/h2-4,14,17,21,23H,1,5-10H2/t14-,17+,18+,19-/m0/s1
InChIKey: UZHSEJADLWPNLE-PIKADFDJSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Papaver somniferum | Papaver | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 327.3800000000001
TPSA？: 70.0
MolLogP？: 1.3014
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | Opioid receptor | Kd | 10000.0 | nM | 10.1021/jm00202a018 |
| Rattus norvegicus | Opioid receptor | Ratio | 10000.0 | None | 10.1021/jm00202a018 |
| None | Unchecked | Activity | nan | None | 10.1021/jm00202a018 |
| None | Unchecked | Inhibition | nan | % | 10.1021/jm00202a018 |
| None | Unchecked | Ratio | 0.001 | None | 10.1021/jm00202a018 |