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(S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID is a chiral chemical compound with the chemical formula C9H17NO5, belonging to the class of amino acids. It features a butyric acid backbone with an amino group and a hydroxyl group attached to the third and fourth carbon atoms, respectively. The "N-BOC" in its name indicates the presence of a BOC (tert-butyloxycarbonyl) protecting group on the amino group, which is commonly used in organic synthesis to shield the amino group from unwanted reactions. (S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID holds potential for applications in organic synthesis and pharmaceutical research, particularly in the development of chiral drugs and complex organic molecules.

83345-44-2

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83345-44-2 Usage

Uses

Used in Organic Synthesis:
(S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID is used as a chiral building block for the synthesis of complex organic molecules. Its unique structure and the presence of the BOC protecting group make it a valuable intermediate in the preparation of various pharmaceuticals and specialty chemicals.
Used in Pharmaceutical Research:
In the pharmaceutical industry, (S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID is used as a key component in the development of chiral drugs. Its chiral nature allows for the creation of enantiomerically pure compounds, which can exhibit different biological activities and reduce potential side effects associated with racemic mixtures.
Used in Drug Synthesis:
(S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID is utilized as a protected amino acid in the synthesis of peptide-based drugs. The BOC protecting group can be selectively removed under mild conditions, allowing for the controlled formation of peptide bonds and the assembly of complex peptide structures.
Used in Chiral Catalysts and Ligands:
In the field of asymmetric catalysis, (S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID can be employed as a chiral ligand or catalyst precursor. Its chiral center and functional groups can be strategically modified to create catalysts that promote enantioselective reactions, leading to the production of enantiomerically enriched compounds.
Used in Biochemical Research:
(S)-N-BOC-3-AMINO-4-HYDROXYBUTYRIC ACID can be used as a chiral probe in biochemical research to study enzyme selectivity, substrate specificity, and the mechanisms of enzymatic reactions. Its unique structure can help elucidate the stereochemical preferences of enzymes and other biomolecules.

Check Digit Verification of cas no

The CAS Registry Mumber 83345-44-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,3,3,4 and 5 respectively; the second part has 2 digits, 4 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 83345-44:
(7*8)+(6*3)+(5*3)+(4*4)+(3*5)+(2*4)+(1*4)=132
132 % 10 = 2
So 83345-44-2 is a valid CAS Registry Number.
InChI:InChI=1/C9H17NO5/c1-9(2,3)15-8(14)10-6(5-11)4-7(12)13/h6,11H,4-5H2,1-3H3,(H,10,14)(H,12,13)/t6-/m0/s1

83345-44-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name (S)-3-((tert-Butoxycarbonyl)amino)-4-hydroxybutanoic acid

1.2 Other means of identification

Product number -
Other names (3S)-4-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:83345-44-2 SDS

83345-44-2Relevant academic research and scientific papers

Synthesis of a novel series of 2,3,4-trisubstituted oxazolidines designed by isosteric replacement or rigidification of the structure and cytotoxic evaluation

Andrade, Saulo F.,Teixeira, Claudia S.,Ramos, Jonas P.,Lopes, Marcela S.,Pdua, Rodrigo M.,Oliveira, Mnica C.,Souza-Fagundes, Elaine M.,Alves, Ricardo J.

, p. 1693 - 1699 (2014/12/11)

We have previously reported on a study of the structure-activity relationship in a series of 2,3,4-substituted oxazolidines recently discovered by our group varying the substituent at the ring or stereochemistry of the oxazolidine ring. We discovered the cytotoxic and pro-apoptotic potential of compounds 1 and 2 with good selectivity against cancer cell lines. In the present study we describe the synthesis and cytotoxic evaluation against cancer cell lines (HL60, JURKAT, MDA-MB-231 and LNCaP) of a series of oxazolidines designed by isosteric replacement or rigidification of the oxymethylene spacer of compounds 1 and 2. Alkenes 3 and 4 retained the activity against MDA-MB-231 cells and they were more active on HL60, JURKAT and LNCaP cells. Considering LNCaP cells, E-isomer 4 was at least 7 times and about 3 times more potent than lead 1 and Z-isomer 3, respectively. Compound 4 exerted significant activity against LNCaP with IC50 in the low micromolar range (11 μM) without affecting VERO cells and PBMC proliferation (IC50 > 100 μM) indicating its low toxicity to normal cells.

Design, synthesis and SAR of novel ethylenediamine and phenylenediamine derivatives as factor Xa inhibitors

Yoshikawa, Kenji,Yoshino, Toshiharu,Yokomizo, Yoshihiro,Uoto, Kouichi,Naito, Hiroyuki,Kawakami, Katsuhiro,Mochizuki, Akiyoshi,Nagata, Tsutomu,Suzuki, Makoto,Kanno, Hideyuki,Takemura, Makoto,Ohta, Toshiharu

scheme or table, p. 2133 - 2140 (2011/04/24)

We previously reported on a series of cyclohexanediamine derivatives as highly potent factor Xa inhibitors. Herein, we describe the modification of the spacer moiety to discover an alternative scaffold. Ethylenediamine derivatives possessing a substituent at the C1 position in S configuration and phenylenediamine derivatives possessing a substituent at the C5 position demonstrated moderate to strong anti-fXa activity. Further SAR studies led to the identification of compound 30h which showed both good in vitro activity (fXa IC50 = 2.2 nM, PTCT2 = 3.9 μM) and in vivo antithrombotic efficacy.

Heteroarylpyrrolopyridinones active as kinase inhibitors

-

Page/Page column 18, (2008/06/13)

Compounds represented by formula (I) wherein A, R1, R2, R3, R4, R5 and R6 are as defined in the specification or a pharmaceutically acceptable salt or solvate thereof, compositions thereof,

A new entry to polyfunctionalized 4,5-trans disubstituted oxazolidin-2-ones from L-aspartic acid

Luppi, Gianluigi,Tomasini, Claudia

, p. 797 - 800 (2007/10/03)

A straightforward synthesis of enantiomerically pure (4R,5S)-5-oxazolidinecarboxylic acid, 2-oxo-4-[(t-butyldimethyl-silyloxy)methyl]-, benzyl ester and of (4S,5S)-4-oxazolidinecarboxylic acid, 2-oxo-5-[(t-butyldimethylsilyloxy)methyl]-, benzyl ester was envisaged starting from readily available L-aspartic acid. The key step is the diastereoselective addition of iodine with the introduction of a new stereogenic centre.

Syntheses of four unusual amino acids, constituents of cyclomarin A

Sugiyama, Hideyuki,Shioiri, Takayuki,Yokokawa, Fumiaki

, p. 3489 - 3492 (2007/10/03)

The stereoselective syntheses of four unusual amino acids, constituents of cyclomarin A, are described. The protected N-methylhydroxyleucine 2 was synthesized using Evans' asymmetric azide-transfer reaction. The unusual amino acid 3 was prepared via diastereoselective methylation of the L-aspartic acid derived lactone 13. The stereoselective formation of threo-β-methoxyphenylalanine 4 was performed via aldol reaction using Scho?llkopf's chiral glycine enolate. The synthesis of N-reverse prenylated tryptophane 5 was achieved by the AQN ligand-promoted Sharpless regioreversed asymmetric aminohydroxylation protocol.

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