Z-L-Methionine - ≥98% , CAS No.1152-62-1

CAS: 1152-62-1 Cat. No.: Z110913 Molecular Weight: 283.34 Beilstein Registry Number: 2058696 EC Number: 214-570-5

GRADE & PURITY ≥98%

Synonyms

(S)-Cbz methionine | A803399 | Z-Met-OH | BENZYLOXYCARBONYL-L-METHIONINE | N-{[(Phenylmethyl)oxy]carbonyl}-L-methionine | N-ALPHA-CARBOBENZOXY-L-METHIONINE | SCHEMBL1157282 | SMR000131860 | AKOS015923286 | MLS000521452 | (2S)-2-(benzyloxycarbonylamino)-4-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

(S)-Cbz methionine | A803399 | Z-Met-OH | BENZYLOXYCARBONYL-L-METHIONINE | N-{[(Phenylmethyl)oxy]carbonyl}-L-methionine | N-ALPHA-CARBOBENZOXY-L-METHIONINE | SCHEMBL1157282 | SMR000131860 | AKOS015923286 | MLS000521452 | (2S)-2-(benzyloxycarbonylamino)-4-

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488191962
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488191962
• Canonical Smiles: CSCCC(C(=O)O)NC(=O)OCC1=CC=CC=C1
• IUPAC Name: (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoic acid
• InChIKey: FPKHNNQXKZMOJJ-NSHDSACASA-N
• INCHI: 1S/C13H17NO4S/c1-19-8-7-11(12(15)16)14-13(17)18-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)(H,15,16)/t11-/m0/s1
• Isomeric SMILES: CSCC[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1
• WGK Germany: 3
• Molecular Weight: 283.34
• Beilstein: 2058696
• Reaxy-Rn: 2058695
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2058695&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Methionine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Methionine and derivatives
• Alternative Parents: Benzyloxycarbonyls Thia fatty acids Carbamate esters Organic carbonic acids and derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Dialkylthioethers Carboxylic acids Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Methionine or derivatives - Benzyloxycarbonyl - Thia fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Carbamic acid ester - Carbonic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Dialkylthioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as methionine and derivatives. These are compounds containing methionine or a derivative thereof resulting from reaction of methionine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)

Discover Target: KDM4A

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

Discover Target: APEX1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Specific Rotation[α]: -26 ° (C=1, MeOH)
• Melt Point(°C): 68°C
• Molecular Weight: 283.350 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 283.088 Da
• Monoisotopic Mass: 283.088 Da
• Topological Polar Surface Area: 101.000 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 292.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1