Compound Q&A

What regulatory guidelines apply to (3S)-2-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid;hydrochloride (CAS: 82586-52-5)?

Answer

(3S)-2-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid;hydrochloride
This compound is subject to the Globally Harmonized System (GHS) of Classification and Labelling of Chemicals, REACH regulations in the EU, and FDA/EPA requirements in the US. It is classified as a pharmaceutical intermediate and should comply with relevant toxicological and environmental regulations.

About

CAS No 82586-52-5
English Name (3S)-2-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid;hydrochloride
Molecular Formula C27H35ClN2O7
Molecular Weight 535.04 g/mol
SMILES CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CC3=CC(=C(C=C3CC2C(=O)O)OC)OC.Cl
InChIKey JXRAXHBVZQZSIC-JKVLGAQCSA-N
Last Updated: 2025-10-05 19:44

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