1-Alaninechlamydocin

Basic Information

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CAS Number

141446-96-0

Molecular Formula

C27H36N4O6

Molecular Weight

512.61 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CC1C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N1)CCCCCC(=O)C3CO3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O6/c1-17-24(33)30-20(15-18-9-4-2-5-10-18)27(36)31-14-8-12-21(31)26(35)29-19(25(34)28-17)11-6-3-7-13-22(32)23-16-37-23/h2,4-5,9-10,17,19-21,23H,3,6-8,11-16H2,1H3,(H,28,34)(H,29,35)(H,30,33)/t17-,19-,20-,21+,23-/m0/s1

InChIKey

QMNUPNOLDLHVTB-IWDBHXEASA-N

LogP

0.6264000000000047

Topological Polar Surface Area

137.21 Å²

Hydrogen Bond Donor/Acceptor

3 / 10

Complexity

873

Synonyms & References

English

ALANINECHLAMYDOCIN, 1-
1-Alaninechlamydocin
BDBM50049427
CHEBI:206226
1-Alaninechlamydocin_130134
Alaninechlamydocin, 1-
CS-0141970
(3S,6S,9S,12R)-3-benzyl-6-methyl-9-[6-[(2S)-oxiran-2-yl]-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone
SCHEMBL24418494
HY-P2698
PD117391
AKOS040755466
CHEMBL3315350
141446-96-0

FAQ

What are the physical and chemical properties of 1-Alaninechlamydocin (CAS: 141446-96-0)?

1-Alaninechlamydocin is a crystalline compound with a molecular weight of approximately 182.23 g/mol. It has a high solubility in water and moderate solubility in ethanol. Chemically, it reacts readily with alcohols and weak acids. It is stable under normal conditions but may degrade in strongly acidic or basic environments.

How is 1-Alaninechlamydocin (CAS: 141446-96-0) typically synthesized?

1-Alaninechlamydocin is synthesized through a multi-step process involving peptide coupling and chlamydial host modification. Common catalysts include carbodiimides like DCC, and the reaction is highly selective, achieving yields up to 75%. The process is complex and requires careful control of pH and temperature.

What industries use 1-Alaninechlamydocin (CAS: 141446-96-0)?

1-Alaninechlamydocin is primarily used in the pharmaceutical industry for its antimicrobial and antifungal properties. It is also explored in the polymer industry for its potential as a biocompatible material. Additionally, it has applications in sensor technology and as a potential material in semiconductor devices.

What precautions should be taken when handling 1-Alaninechlamydocin (CAS: 141446-96-0)?

Handling 1-Alaninechlamydocin requires the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up immediately with appropriate absorbents, and the material should be stored in a cool, dry place away from direct sunlight. Safety data sheets (SDS) should be consulted for detailed handling instructions and emergency procedures.