(5S)-5-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methyl-2H,5H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-4-ol

AlkaPlorer ID: AK106726

Synonym: None

IUPAC Name: (5S)-5-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-4-ol

Structure

SMILES: COC1=CC=C(C[C@H]2C3=C(O)C4=C(C=C3CCN2C)OCO4)C=C1O

copy

InChI: InChI=1S/C19H21NO5/c1-20-6-5-12-9-16-19(25-10-24-16)18(22)17(12)13(20)7-11-3-4-15(23-2)14(21)8-11/h3-4,8-9,13,21-22H,5-7,10H2,1-2H3/t13-/m0/s1

copy

InChIKey: NBEREFJAHQPIOC-ZDUSSCGKSA-N

copy

Source

Properties Information

Molecule Weight: 343.3790000000001

TPSA: 71.39000000000001

MolLogP: 2.606800000000001

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information