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Glycerol phenylbutyrate - 10mM in DMSO, high purity , CAS No.611168-24-2(DMSO), Glutamine sequestering agent
Basic Description
Synonyms
GLYCEROL PHENYLBUTYRATE | 611168-24-2 | Ravicti | HPN-100 | GT4P | Glycerolphenylbutyrate | HPN100 | UNII-ZH6F1VCV7B | ZH6F1VCV7B | Propane-1,2,3-triyl tris(4-phenylbutanoate) | Tris(4-phenylbutyryl)glycerol | Glyceryl Tri-4-Phenylbutyrate | Glyceryl tri-(4-phenylbutyrate) | HPN 1
Specifications & Purity
10mM in DMSO
Storage Temp
Store at -80°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
SEQUESTERING AGENT
Mechanism of action
Glutamine sequestering agent
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Glycerolipids
Subclass
Triradylcglycerols
Intermediate Tree Nodes
Not available
Direct Parent
Triacylglycerols
Alternative Parents
Tricarboxylic acids and derivatives Fatty acid esters Benzene and substituted derivatives Carboxylic acid esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Triacyl-sn-glycerol - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as triacylglycerols. These are glycerides consisting of three fatty acid chains covalently bonded to a glycerol molecule through ester linkages.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
2,3-bis(4-phenylbutanoyloxy)propyl 4-phenylbutanoate
INCHI
InChI=1S/C33H38O6/c34-31(22-10-19-27-13-4-1-5-14-27)37-25-30(39-33(36)24-12-21-29-17-8-3-9-18-29)26-38-32(35)23-11-20-28-15-6-2-7-16-28/h1-9,13-18,30H,10-12,19-26H2
InChIKey
ZSDBFLMJVAGKOU-UHFFFAOYSA-N
Smiles
C1=CC=C(C=C1)CCCC(=O)OCC(COC(=O)CCCC2=CC=CC=C2)OC(=O)CCCC3=CC=CC=C3
Isomeric SMILES
C1=CC=C(C=C1)CCCC(=O)OCC(COC(=O)CCCC2=CC=CC=C2)OC(=O)CCCC3=CC=CC=C3
Molecular Weight
530.6
Reaxy-Rn
23716351
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23716351&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
530.600 g/mol
XLogP3
6.700
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
20
Exact Mass
530.267 Da
Monoisotopic Mass
530.267 Da
Topological Polar Surface Area
78.900 Ų
Heavy Atom Count
39
Formal Charge
0
Complexity
648.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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