Compound Q&A

What is (2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-Ethoxy-1-oxo-2-pentanyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid - 2-methyl-2-propanamine (1:1) (CAS: 107133-36-8)?

Answer

(2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-Ethoxy-1-oxo-2-pentanyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid - 2-methyl-2-propanamine (1:1) (non-preferred name)
This compound, with the CAS number 107133-36-8, is a complex organic molecule containing an indole ring and multiple chiral centers. It is a derivative of indole-2-carboxylic acid, with structural modifications including ethoxy and methyl groups. The compound exhibits specific stereochemistry, with the (2S,3aS,7aS) and (2S) configurations, making it relevant in specialized chemical applications. It is commonly used in research settings for its potential pharmacological properties.

About

English Name (2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-Ethoxy-1-oxo-2-pentanyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid - 2-methyl-2-propanamine (1:1) (non-preferred name)
Molecular Formula C23H43N3O5
Molecular Weight 441.61 g/mol
SMILES CCCC(C(=O)OCC)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O.CC(C)(C)N
InChIKey IYNMDWMQHSMDDE-MHXJNQAMSA-N
Last Updated: 2025-08-25 01:09

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