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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000258

Thaligrisine

Formula: C37H42N2O6  |  Mol. Weight: 610.70 g/mol

IUPAC: (1S)-1-[[4-[5-[[(1R)-7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol

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Overview

Molecular Formula C37H42N2O6
Molecular Weight 610.70 g/mol
Canonical SMILES CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)OC)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy