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(4-Nitrophenyl)methyl [5R-[5alpha,6alpha(R)]]-6-(1-hydroxyethyl)-3-[[2-[[[(4-nitrophenyl)methoxy]carbonyl]amino]ethyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate is a complex organic compound that serves as an intermediate in the synthesis of Thienamycin (T344270), a potent naturally produced antibiotic with broad-spectrum activity against both Gram-positive and Gram-negative bacteria. (4-nitrophenyl)methyl [5R-[5alpha,6alpha(R)]]-6-(1-hydroxyethyl)-3-[[2-[[[(4-nitrophenyl)methoxy]carbonyl]amino]ethyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate is characterized by its unique molecular structure, which includes a 1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate core, a 4-nitrophenylmethoxycarbonyl group, and a hydroxyethylthio side chain.

64067-13-6

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64067-13-6 Usage

Uses

Used in Pharmaceutical Industry:
(4-Nitrophenyl)methyl [5R-[5alpha,6alpha(R)]]-6-(1-hydroxyethyl)-3-[[2-[[[(4-nitrophenyl)methoxy]carbonyl]amino]ethyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate is used as an intermediate in the synthesis of Thienamycin (T344270) for its potent antibiotic properties. Thienamycin exhibits excellent activity against a wide range of bacteria, including both Gram-positive and Gram-negative strains, and is resistant to bacterial β-lactamase enzymes, making it a valuable asset in the development of new antibiotics to combat drug-resistant infections.

Check Digit Verification of cas no

The CAS Registry Mumber 64067-13-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,4,0,6 and 7 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 64067-13:
(7*6)+(6*4)+(5*0)+(4*6)+(3*7)+(2*1)+(1*3)=116
116 % 10 = 6
So 64067-13-6 is a valid CAS Registry Number.

64067-13-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name (4-nitrophenyl)methyl (5R)-6-[(1R)-1-hydroxyethyl]-3-[2-[(4-nitrophenyl)methoxycarbonylamino]ethylsulfanyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

1.2 Other means of identification

Product number -
Other names EINECS 264-650-9

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:64067-13-6 SDS

64067-13-6Upstream product

64067-13-6Relevant academic research and scientific papers

A new strategy for the synthesis of carbapenems. A formal total synthesis of (+)-thienamycin

Feigelson, Gregg B.

, p. 4747 - 4750 (2007/10/02)

A new approach to formation of the carbapenem ring system is presented. The key step involves the Lewis acid mediated cyclocondensation of a β-lactam nitrogen and the α-keto ester of a suitably disposed side-chain. The preparation of a known and pivotal intermediadate in the synthesis of thienamycin serves to demonstrate this strategy.

Stereoselective reactions. XX. Synthetic studies on optically active β-lactams. III. Stereocontrolled synthesis of chiral intermediate to (+)-thienamycin from D-glucose

Ikota,Yoshino,Koga

, p. 2201 - 2206 (2007/10/02)

A chiral key intermediate (19a) for the synthesis of (+)-thienamycin was synthesized starting from D-glucose. The enol ether 13, obtained from the ketone 11 by Horner-Wittig reaction, was transformed to the corresponding methyl ester 16 by pyridinium chlorochromate oxidation or by employing the Wacker process. The ester 16 was further converted to the β-lactam 19a, which is a useful chiral precursor to (+)-thienamycin.

A Novel Ring-Closure Strategy for the Carbapenems: The Total Synthesis of (+)-Thienamycin

Hanessian, Stephen,Desilets, Denis,Bennani, Youssef L.

, p. 3098 - 3103 (2007/10/02)

Intramolecular Michael cyclization of an N--4-(3-nitro-2-propenyl)-3-oxoazetidin-2-one available in optically pure form leads to the corresponding carbapenam skeleton.Further elaboration via oxidative cleavage of an exocyclic nitromethylene group gives an advanced intermediate, which was transformed into (+)-thienamycin.The stereochemistry of the Michael cyclization and the pitfalls of protective group chemistry are discussed.

AN EFFICIENT CARBAPENEM SYNTHESIS VIA AN INTRAMOLECULAR WITTIG REACTION OF NEW TRIALKOXYPHOSPHORANE-THIOLESTERS

Yoshida, Akira,Tajima, Yawara,Takeda, Noriko,Oida, Sadao

, p. 2793 - 2796 (2007/10/02)

New trialkoxyphosphorane-thiolesters 10, obtained by reaction of oxalimides 9 with trialkyl phosphite, were efficiently cyclized by an intramolecular Wittig reaction to give carbapenems 11.

Inversion of Configuration at C-8 in the Olivanic Acids: Conversion into the Thienamycins and Other Novel Derivatives

Corbett, David F.,Coulton, Steven,Southgate, Robert

, p. 3011 - 3016 (2007/10/02)

The inversion of stereochemistry at C-8 in the olivanic acids, MM 22383 (7) and MM 22381 (6), is described.The reaction of p-nitrobenzyl (5R,6S)-3--6--7-oxo-1-azabicyclohept-2-ene-2-carboxylate (8) with diethyl azodicarboxylate, triphenylphosphine, and formic acid afforded the 6- derivative (17), which upon alkaline hydrolysis gave the 6- derivative (18).Hydrolysis of the p-nitrobenzyl ester (18) furnished the sodium salt of N-acetyldehydrothienamycin (15), the (8R)-epimer of the olivanic acid MM 22383 (7).The 3-(2-acetamidoethylthio)-analogue, MM 22381 (6), was converted into N-acetylthienamycin (14) by performing a similar series of reactions on its p-nitrobenzyl ester (10).The transformation of the ester (18) to bis-protected thienamycin (22), via the C-3 thiol (21), is also described.Reaction of the olivanic acid esters (8) and (10) with diethyl azodicarboxylate, triphenylphosphine and hydrazoic acid resulted in the formation of the 6- derivatives (27) and (28).Subsequent hydrolysis provided (5R,6R)-3--6--7-oxo-1-azabicyclohept-2-ene-2-carboxylic acid (29) and the 3-(2-acetamidoethylthio)-analogue (30).

A DIRECT TRANSFORMATION OF BICYCLIC KETO ESTERS TO N-FORMIMIDOYL THIENAMYCIN

Shinkai, I.,Reamer, R. A.,Hartner, F. W.,Liu, T.,Sletzinger, M.

, p. 4903 - 4906 (2007/10/02)

A convenient direct transformation of p-nitrobenzyl 6-(1'-hydroxyethyl)-azabicyclo-(3.2.0)heptane-3,7-dione-2-carboxylate to N-formimidoyl thienamycin utilizing the silylated derivative of N-formimidoyl cysteamine is described.

Thienamycin Total Synthesis. 3. Total Synthesis of (+/-)-Thienamycin and (+/-)-8-Epithienamycin

Schmitt, Susan M.,Johnston, David B.R.,Christensen, B.G.

, p. 1142 - 1148 (2007/10/02)

The completion of the total synthesis of (+/-)-8-epithienamycin and (+/-)-thienamycin from azetidinones 3a and 3b using the methodology developed for the synthesis of model compound 4 (see part 2) is described.

A PRACTICAL SYNTHESIS OF (+/-)-THIENAMYCIN

Melillo, D.G.,Shinkai, I.,Liu, T.,Ryan, K.,Sletzinger, M.

, p. 2783 - 2786 (2007/10/02)

An efficient and operationally simply synthesis of (+/-)-thienamycin is described.

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