N-(2-Amino-3-hydroxy-4-methylbenzoyl)threonylvalylproline structure

N-(2-Amino-3-hydroxy-4-methylbenzoyl)threonylvalylproline

1-[2-[[2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid

Also Known As: N-(2-Amino-3-hydroxy-4-methylbenzoyl)threonylvalylproline|1-[2-[[2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid

CAS: 6041-33-4
Molecular Formula C22H32N4O7
Molecular Weight 464.2271 g/mol
LogP 1.2
Topological Polar Surface Area 182.0 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 8
Rotatable Bonds 8
Exact Mass 464.2271
Monoisotopic Mass 464.2271
Heavy Atoms 33
Complexity 746.0

Chemical Identifiers

CAS Number 6041-33-4
SMILES CC1=C(C(=C(C=C1)C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)N2CCCC2C(=O)O)N)O
InChIKey WZFYWDCIMKNSDK-UHFFFAOYSA-N

Product Overview

N-(2-Amino-3-hydroxy-4-methylbenzoyl)threonylvalylproline (CAS 6041-33-4), with molecular formula C22H32N4O7 and molecular weight 464.2271 g/mol. IUPAC: 1-[2-[[2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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N-(2-Amino-3-hydroxy-4-methylbenzoyl)threonylvalylproline is a custom synthesis product. We offer services from milligram to kilogram scale.

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