(-)-4'-O-Methylcoclaurine
AlkaPlorer ID: AK107287
Synonym: "4'-O-Methylcoclaurine"
IUPAC Name: (1S)-6-methoxy-1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-7-ol
Structure
SMILES: COC1=CC=C(C[C@@H]2NCCC3=CC(OC)=C(O)C=C32)C=C1
InChI: InChI=1S/C18H21NO3/c1-21-14-5-3-12(4-6-14)9-16-15-11-17(20)18(22-2)10-13(15)7-8-19-16/h3-6,10-11,16,19-20H,7-9H2,1-2H3/t16-/m0/s1
InChIKey: XIEZJSPLHXEHSK-INIZCTEOSA-N
Reference
Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora
PubChem CID: 24944443
LOTUS: LTS0261808
SuperNatural Ⅲ: SN0430874-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylopia parviflora | Xylopia | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 299.37
TPSA？: 50.72
MolLogP？: 2.8389000000000006
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|