(1S)-5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline
AlkaPlorer ID: AK036942
Synonym: None
IUPAC Name: (1S)-5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline
Structure
SMILES: COC1=CC=C(C[C@@H]2NCCC3=C(OC)C(OC)=C(OC)C=C32)C=C1
InChI: InChI=1S/C20H25NO4/c1-22-14-7-5-13(6-8-14)11-17-16-12-18(23-2)20(25-4)19(24-3)15(16)9-10-21-17/h5-8,12,17,21H,9-11H2,1-4H3/t17-/m0/s1
InChIKey: CMQSBRRTRZPLHE-KRWDZBQOSA-N
Reference
Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora
PubChem CID: 162906358
LOTUS: LTS0276145
SuperNatural Ⅲ: SN0049959-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylopia parviflora | Xylopia | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 343.42300000000006
TPSA？: 48.95
MolLogP？: 3.150500000000002
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|