Calycotomine; (ξ)-form, O7-De-Me, N-Me
AlkaPlorer ID: AK291493
Synonym: 1,2,3,4-Tetrahydro-7-hydroxy-6-methoxy-2-methyl-1-isoquinolinemethanol, 1,2,3,4-Tetrahydro-7-hydroxy-1-hydroxymethyl-6-methoxy-2-methylisoquinoline, Hedycarine
IUPAC Name: 1-(hydroxymethyl)-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
Structure
SMILES: COC1=CC2=C(C=C1O)C(CO)N(C)CC2
InChI: InChI=1S/C12H17NO3/c1-13-4-3-8-5-12(16-2)11(15)6-9(8)10(13)7-14/h5-6,10,14-15H,3-4,7H2,1-2H3
InChIKey: PGHHKZLRKIHXEW-UHFFFAOYSA-N
Reference
PubChem CID: 134853696
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Hedycarya | Monimiaceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 223.272
TPSA？: 52.93
MolLogP？: 0.9221
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|