Acetyl-tyrosyl-prolyl-methylasparaginamide structure

Acetyl-tyrosyl-prolyl-methylasparaginamide

(2S)-N-[(2S)-1-[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]-2-amino-N-methylbutanediamide

Also Known As: Ac-Tyr-pro-asn-nhme|Acetyl-tyrosyl-prolyl-methylasparaginamide|L-Aspartamide, N-acetyl-L-tyrosyl-L-prolyl-N1-methyl-|N-(1-Hydroxyethylidene)tyrosyl-N-(2-amino-4-hydroxy-4-iminobutanoyl)-N-methylprolinamide|(2S)-N-[(2S)-1-[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]-2-amino-N-methylbutanediamide|N-(1-Hydroxyethylidene)-L-tyrosyl-N-[(2S)-2-amino-4-hydroxy-4-iminobutanoyl]-N-methyl-L-prolinamide

CAS: 82867-72-9
Molecular Formula C21H29N5O6
Molecular Weight 447.2118 g/mol
LogP -1.3819
Topological Polar Surface Area 176.13 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 447.2118
Monoisotopic Mass 447.2118
Heavy Atoms 32
Complexity 887.1713

Chemical Identifiers

CAS Number 82867-72-9
SMILES CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)N(C)C(=O)[C@H](CC(=O)N)N

Product Overview

Acetyl-tyrosyl-prolyl-methylasparaginamide (CAS 82867-72-9), with molecular formula C21H29N5O6 and molecular weight 447.2118 g/mol. IUPAC: (2S)-N-[(2S)-1-[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]-2-amino-N-methylbutanediamide.

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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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