Norstephalagine
AlkaPlorer ID: AK025484
Synonym: None
IUPAC Name: (12R)-7-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),14,16,18-hexaene
Structure
SMILES: COC1=C2CCN[C@@H]3CC4=CC=CC=C4C(=C23)C2=C1OCO2
InChI: InChI=1S/C18H17NO3/c1-20-16-12-6-7-19-13-8-10-4-2-3-5-11(10)15(14(12)13)17-18(16)22-9-21-17/h2-5,13,19H,6-9H2,1H3/t13-/m1/s1
InChIKey: TYZKUSBTFHNPMV-CYBMUJFWSA-N
Reference
The Alkaloids of <i>Artabotrys </i><i>u</i><i>ncinatus</i>
PubChem CID: 133381
CAS: 80151-82-2
LOTUS: LTS0081572
SuperNatural Ⅲ: SN0363889-01
NPASS: NPC112575
data_source: manually
Source
Properties Information
Molecule Weight: 295.3380000000001
TPSA？: 39.72
MolLogP？: 2.833800000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | Dopamine D1 receptor | IC50 | 4800.0 | nM | 10.1021/jm060959i |
| Rattus norvegicus | Dopamine D2 receptor | IC50 | 27000.0 | nM | 10.1021/jm060959i |
| Rattus norvegicus | Dopamine transporter | IC50 | 1400.0 | nM | 10.1021/jm060959i |
| Rattus norvegicus | Dopamine transporter | IC50 | 1400.0 | nM | 10.1021/np50124a001 |
| None | Unchecked | Ratio IC50 | 3.4 | None | 10.1021/np50124a001 |
| None | Unchecked | Ratio IC50 | 19.6 | None | 10.1021/np50124a001 |