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L-Tagatose - >98.0%(HPLC), high purity , CAS No.17598-82-2
Basic Description
Synonyms
L-LYXO-2-hexulose | L-Tagatose | L-Tagatose [MI] | 41IX5VHE3I | CHEBI:134275 | Tagatose, L- | HY-W145570 | C21523 | UNII-41IX5VHE3I | Q27258441 | (3R,4R,5S)-1,3,4,5,6-Pentahydroxyhexan-2-one | L - tagatose | T2535 | D92607 | SCHEMBL9710274 | D-Psicose, >=
Specifications & Purity
≥98%(HPLC)
Storage Temp
Argon charged
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Monosaccharides
Alternative Parents
Beta-hydroxy ketones Acyloins Alpha-hydroxy ketones Secondary alcohols 1,2-diols Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Monosaccharide - Beta-hydroxy ketone - Acyloin - Alpha-hydroxy ketone - Secondary alcohol - Ketone - 1,2-diol - Polyol - Organic oxide - Hydrocarbon derivative - Primary alcohol - Carbonyl group - Alcohol - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as monosaccharides. These are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn.
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
Pubchem Sid
488196997
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488196997
IUPAC Name
(3R,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one
INCHI
InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5+,6-/m0/s1
InChIKey
BJHIKXHVCXFQLS-LFRDXLMFSA-N
Smiles
C(C(C(C(C(=O)CO)O)O)O)O
Isomeric SMILES
C([C@@H]([C@H]([C@H](C(=O)CO)O)O)O)O
Molecular Weight
180.16
Beilstein
1(4)4415
Reaxy-Rn
2207947
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2207947&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in water
Sensitivity
Moisture sensitive
Specific Rotation[α]
6° (C=1,H2O)
Melt Point(°C)
131 °C
Molecular Weight
180.160 g/mol
XLogP3
-3.200
Hydrogen Bond Donor Count
5
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
5
Exact Mass
180.063 Da
Monoisotopic Mass
180.063 Da
Topological Polar Surface Area
118.000 Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
147.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
3
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
Citations of This Product
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2 Citations
G2020168