Dicentrine; (S)-form, N-Me
AlkaPlorer ID: AK295498
Synonym: N-Methyldicentrinium
IUPAC Name: 16,17-dimethoxy-11,11-dimethyl-3,5-dioxa-11-azoniapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaene
Structure
SMILES: COC1=CC2=C(C=C1OC)C1=C3OCOC3=CC3=C1C(C2)[N+](C)(C)CC3
InChI: InChI=1S/C21H24NO4/c1-22(2)6-5-12-8-18-21(26-11-25-18)20-14-10-17(24-4)16(23-3)9-13(14)7-15(22)19(12)20/h8-10,15H,5-7,11H2,1-4H3/q+1
InChIKey: YKPZMCOXWBQMKJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dicentra peregrina | Dicentra | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 354.4260000000001
TPSA？: 36.92
MolLogP？: 3.329200000000002
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|