(1S)-2-[(3-hydroxy-4-methoxyphenyl)methyl]-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-6-ol
AlkaPlorer ID: AK092223
Synonym: None
IUPAC Name: (1S)-2-[(3-hydroxy-4-methoxyphenyl)methyl]-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-6-ol
Structure
SMILES: COC1=CC=C(CN2CCC3=CC(O)=C(OC)C=C3[C@@H]2C)C=C1O
InChI: InChI=1S/C19H23NO4/c1-12-15-10-19(24-3)17(22)9-14(15)6-7-20(12)11-13-4-5-18(23-2)16(21)8-13/h4-5,8-10,12,21-22H,6-7,11H2,1-3H3/t12-/m0/s1
InChIKey: MVYDGBDFTMESDC-LBPRGKRZSA-N
Reference
Berberis alkaloids XXXV. The structure of nummularine
PubChem CID: 163040189
LOTUS: LTS0075152
SuperNatural Ⅲ: SN0236853-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Berberis nummularia | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 329.3960000000001
TPSA？: 62.16000000000001
MolLogP？: 3.2343000000000024
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|