Higenamine; (R)-form, N-Me, N-oxide(R-)
AlkaPlorer ID: AK300410
Synonym: N-Methylhigenamine N-oxide
IUPAC Name: 1-[(4-hydroxyphenyl)methyl]-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-6,7-diol
Structure
SMILES: C[N+]1([O-])CCC2=CC(O)=C(O)C=C2C1CC1=CC=C(O)C=C1
InChI: InChI=1S/C17H19NO4/c1-18(22)7-6-12-9-16(20)17(21)10-14(12)15(18)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,19-21H,6-8H2,1H3
InChIKey: NBVMNDIZMDPDMC-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gnetum parvifolium | Gnetum | Gnetaceae | Gnetales | Gnetopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 301.34200000000004
TPSA？: 83.75
MolLogP？: 2.5877000000000008
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|