CAS 201419-16-1

N-[(1,1-Dimethylethoxy)carbonyl]-S-(triphenylmethyl)-L-homocysteine

Description:

N-[(1,1-Dimethylethoxy)carbonyl]-S-(triphenylmethyl)-L-homocysteine is a synthetic compound that belongs to the class of amino acids, specifically a derivative of homocysteine. This compound features a homocysteine backbone, which is an important amino acid involved in various metabolic processes, particularly in the synthesis of cysteine and methionine. The presence of the triphenylmethyl group provides significant steric hindrance, which can influence the compound's reactivity and interactions with biological systems. The dimethylethoxycarbonyl group serves as a protective moiety, enhancing the stability of the molecule during synthesis and potentially modulating its biological activity. This compound may be of interest in medicinal chemistry and biochemistry for its potential applications in drug development or as a biochemical probe. Its unique structural features contribute to its properties, including solubility, reactivity, and biological interactions, making it a subject of study in various chemical and pharmaceutical research contexts.

Formula: C₂₈H₃₁NO₄S

InChI: InChI=1S/C28H31NO4S/c1-27(2,3)33-26(32)29-24(25(30)31)19-20-34-28(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,24H,19-20H2,1-3H3,(H,29,32)(H,30,31)/t24-/m0/s1

InChI key: InChIKey=YBAYCOKLWMVUSV-DEOSSOPVSA-N

SMILES: C(SCC[C@H](NC(OC(C)(C)C)=O)C(O)=O)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Synonyms:

• N-[(1,1-Dimethylethoxy)carbonyl]-S-(triphenylmethyl)-L-homocysteine
• N-tert-Butoxycarbonyl-S-trityl-L-homocysteine
• (S)-2-((tert-Butoxycarbonyl)amino)-4-(tritylthio)butanoic acid
• L-Homocysteine, N-[(1,1-dimethylethoxy)carbonyl]-S-(triphenylmethyl)-

Boc-Homocys(Trt)-OH

CAS: 201419-16-1

Bachem ID: 4025120.

Formula: C₂₈H₃₁NO₄S

Purity: > 99%

Color and Shape: White Powder

Molecular weight: 477.62

Ref: 01-4025120

Boc-S-Trityl-L-Homocysteine

CAS: 201419-16-1

Boc-S-Trityl-L-Homocysteine

Formula: C₂₈H₃₁NO₄S

Purity: 95%

Color and Shape: Solid

Molecular weight: 477.61503

Ref: 54-OR53086

L-Homocysteine,N-[(1,1-dimethylethoxy)carbonyl]-S-(triphenylmethyl)-

CAS: 201419-16-1

Formula: C₂₈H₃₁NO₄S

Purity: 98%

Color and Shape: Solid

Molecular weight: 477.6150

Ref: IN-DA002DEG

Boc-HoCys(Trt)-OH

CAS: 201419-16-1

(S)-2-((tert-Butoxycarbonyl)amino)-4-(tritylthio)butanoic acid

Formula: C₂₈H₃₁NO₄S

Purity: 95%

Molecular weight: 477.62

Ref: IN-DG32531

Boc-L-HomoCys(Trt)-OH

CAS: 201419-16-1

Formula: C₂₈H₃₁NO₄S

Purity: 95%

Color and Shape: Solid

Molecular weight: 477.62

Ref: 10-F300152

Boc-S-trityl-L-homocysteine

CAS: 201419-16-1

Boc-S-trityl-L-homocysteine is a synthetic molecule that is used as a prodrug to introduce the amino acid homocysteine into cells. It has been shown to have anti-cancer and estrogen receptor modulating properties. Boc-S-trityl-L-homocysteine is synthesized by reacting L-homocysteine with diisopropylamino chlorides in the presence of sodium hydroxide, followed by ligation with dicyclohexylcarbodiimide. The compound adopts a centrosymmetric conformation due to the presence of two chiral centers at C3 and C4 positions on the pyridyl ring. The active site consists of an aromatic ring with three substituents, one of which is an amide group. This chemical transformation occurs through a nucleophilic attack by the amide group on an electrophilic carbonyl carbon atom.

Formula: C₂₈H₃₁NO₄S

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 477.62 g/mol

Ref: 3D-FB47898