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4386-03-2 molecular structure
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4-[(2-carboxyethyl)amino]butanoic acid

ChemBase ID: 104166
Molecular Formular: C7H13NO4
Molecular Mass: 175.18242
Monoisotopic Mass: 175.0844579
SMILES and InChIs

SMILES:
OC(=O)CCCNCCC(=O)O
Canonical SMILES:
OC(=O)CCNCCCC(=O)O
InChI:
InChI=1S/C7H13NO4/c9-6(10)2-1-4-8-5-3-7(11)12/h8H,1-5H2,(H,9,10)(H,11,12)
InChIKey:
SRGQUICKDUQCKO-UHFFFAOYSA-N

Cite this record

CBID:104166 http://www.chembase.cn/molecule-104166.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-[(2-carboxyethyl)amino]butanoic acid
IUPAC Traditional name
cegaba
Synonyms
CEGABA
Carboxyethyl-γ-aminobutyric acid
CARBOXYETHYL-γ-AMINOBUTYRIC ACID
CAS Number
4386-03-2
EC Number
224-497-0
MDL Number
MFCD00057954
PubChem SID
24892375
24892796
162091498
PubChem CID
2572

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 2572 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 3.3644464  H Acceptors
H Donor LogD (pH = 5.5) -4.1829543 
LogD (pH = 7.4) -5.919053  Log P -3.1716874 
Molar Refractivity 41.0164 cm3 Polarizability 16.30556 Å3
Polar Surface Area 86.63 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
cell culture medium: soluble1.5 mg/mL (Store solution at -20°C.) expand Show data source
H2O: soluble (Store solution at -20°C.) expand Show data source
Apperance
powder expand Show data source
RTECS
EK7730000 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Purity
≥80% (HPLC) expand Show data source
97% expand Show data source
Grade
Hybri-Max™ expand Show data source
Certificate of Analysis
Download expand Show data source
Suitability
suitable for hybridoma expand Show data source
Impurities
endotoxin, tested expand Show data source
Sterility
γ-irradiated expand Show data source
Quality Level
GMP expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 02154937 external link
(CEGABA) Purity: 97% Cell growth promoter.
Sigma Aldrich - C1181 external link
Biochem/physiol Actions
Cell growth promoter
Sigma Aldrich - C5556 external link
Application
Stimulates hybridoma growth.
Biochem/physiol Actions
A polyamine derivative that stimulates the growth of hybridoma cells.
Cell growth promoter
法律信息
Hybri-Max 商标 Sigma-Aldrich Co. LLC
Other Notes
Tandem Mass Spectrometry data independently generated by Scripps Center for Metabolomics is available to view or download in PDF. C5556.pdf Tested metabolites are featured on Scripps Center for Metabolomics METLIN Metabolite Database. To learn more, visit sigma.com/metlin.
Tandem Mass Spectrometry data independently generated by Scripps Center for Metabolomics is available to view or download in PDF. C5556.pdf Tested metabolites are featured on Scripps Center for Metabolomics METLIN Metabolite Database. To learn more, visit sigma.com/metlin.

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • Cerino, et al., J. Immunol. Methods, 77: 229, (1985).
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PATENTS

PATENTS

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INTERNET

INTERNET

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