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59-23-4 molecular structure
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(2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal

ChemBase ID: 102453
Molecular Formular: C6H12O6
Molecular Mass: 180.15588
Monoisotopic Mass: 180.0633881
SMILES and InChIs

SMILES:
O=C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO
Canonical SMILES:
OC[C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O
InChI:
InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6-/m0/s1
InChIKey:
GZCGUPFRVQAUEE-KCDKBNATSA-N

Cite this record

CBID:102453 http://www.chembase.cn/molecule-102453.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal
IUPAC Traditional name
aldehydo-D-galactose
Synonyms
Cerebrose
D-(+)-GALACTOSE ANHYDROUS
D-(+)-Galactose
D-Galactose
D-(+)-半乳糖
CAS Number
59-23-4
EC Number
200-416-4
MDL Number
MFCD00151230
Beilstein Number
1724619
PubChem SID
24849498
162089793
24895207
24895256
24895021
24871834
24871832
24895019
PubChem CID
3037556

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 12.256455  H Acceptors
H Donor LogD (pH = 5.5) -3.5683606 
LogD (pH = 7.4) -3.5683665  Log P -3.5683606 
Molar Refractivity 37.3456 cm3 Polarizability 15.251392 Å3
Polar Surface Area 118.22 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
H2O: soluble0.1 g/mL, clear, colorless expand Show data source
H2O: soluble1 M at 20 °C, clear, colorless expand Show data source
H2O: soluble100 mg/mL expand Show data source
Apperance
powder expand Show data source
Melting Point
167-170 °C (dec.) expand Show data source
168-170 °C(lit.) expand Show data source
168-170°C expand Show data source
Optical Rotation
[α]20/D +78.0 to +81.5° (anhydrous substance) expand Show data source
[α]20/D +80.2°, c = 2 in H2O expand Show data source
[α]20/D +80±1°, 24 hr, c = 5% in H2O expand Show data source
Absorption Wavelength
λ: 260 nm Amax: 0.05 expand Show data source
λ: 280 nm Amax: 0.05 expand Show data source
pH
5.0-7.0 (20 °C, 1 M in H2O) expand Show data source
5.0-7.0 (25 °C, 1 M in H2O) expand Show data source
Storage Condition
Room Temperature (15-30°C) expand Show data source
RTECS
LW5490000 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
Purity
≥98% expand Show data source
≥99% expand Show data source
≥99.0% expand Show data source
≥99.0% (sum of enantiomers, HPLC) expand Show data source
≥99.5% (sum of enantiomers, HPLC) expand Show data source
97% expand Show data source
98% expand Show data source
Grade
anhydrous expand Show data source
for microbiology expand Show data source
Certificate of Analysis
Download expand Show data source
Download expand Show data source
Suitability
in accordance for appearance of solution expand Show data source
in accordance for identity (IR) expand Show data source
suitable for cell culture expand Show data source
suitable for insect cell culture expand Show data source
Ignition Residue
≤0.05% (as SO4) expand Show data source
≤0.1% expand Show data source
≤0.1% (as SO4) expand Show data source
Impurities
≤0.005% Phosphorus (P) expand Show data source
≤0.1% glucose expand Show data source
≤0.1% Insoluble matter expand Show data source
≤1.0% water (Karl Fischer) expand Show data source
acid. or alk. react. impurities, in accordance expand Show data source
insoluble matter, passes filter test expand Show data source
microbiological impurity, in accordance expand Show data source
residual solvents, in accordance expand Show data source
Cation Traces
Al: ≤0.0005% expand Show data source
Al: ≤5 mg/kg expand Show data source
As: ≤0.1 mg/kg expand Show data source
Ba: ≤5 mg/kg expand Show data source
Ba:, in accordance expand Show data source
Bi: ≤5 mg/kg expand Show data source
Ca: ≤0.005% expand Show data source
Ca: ≤10 mg/kg expand Show data source
Ca: ≤20 mg/kg expand Show data source
Cd: ≤5 mg/kg expand Show data source
Co: ≤5 mg/kg expand Show data source
Cr: ≤5 mg/kg expand Show data source
Cu: ≤0.0005% expand Show data source
Cu: ≤5 mg/kg expand Show data source
Fe: ≤0.0005% expand Show data source
Fe: ≤5 mg/kg expand Show data source
K: ≤0.005% expand Show data source
K: ≤50 mg/kg expand Show data source
Li: ≤5 mg/kg expand Show data source
Mg: ≤0.0005% expand Show data source
Mg: ≤5 mg/kg expand Show data source
Mn: ≤5 mg/kg expand Show data source
Mo: ≤5 mg/kg expand Show data source
Na: ≤0.005% expand Show data source
Na: ≤50 mg/kg expand Show data source
NH4+: ≤0.05% expand Show data source
Ni: ≤5 mg/kg expand Show data source
Pb: ≤0.001% expand Show data source
Pb: ≤0.5 mg/kg expand Show data source
Pb: ≤5 mg/kg expand Show data source
Sr: ≤5 mg/kg expand Show data source
Zn: ≤0.0005% expand Show data source
Zn: ≤5 mg/kg expand Show data source
Antion Traces
chloride (Cl-): ≤0.05% expand Show data source
chloride (Cl-): ≤50 mg/kg expand Show data source
sulfate (SO42-): ≤0.05% expand Show data source
sulfate (SO42-): ≤50 mg/kg expand Show data source
Loss on Drying
≤0.05% loss on drying expand Show data source
≤0.1% loss on drying expand Show data source
Quality Level
PREMIUM expand Show data source
Quality
meets analytical specification of Ph. Eur., BP expand Show data source
λ
1 M in H2O expand Show data source
Product Line
BioUltra expand Show data source
Empirical Formula (Hill Notation)
C6H12O6 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 02194670 external link
Cell Culture Reagent
Anhydrous
Crystalline
Purity: 98%
MP Biomedicals - 02101747 external link
Crystalline
Purity: 98%
Sigma Aldrich - 48259 external link
Other Notes
Specifically inhibits agglutination of mouse spleen lymphocytes by soybean agglutinin1
Application
D-(+)-Galactose (D-Gal) is a component with glucose of the disaccharide lactose. Galactose may be used in studies on galactose metabolism as the substrate for indentificaiton, differentiation and characterization of enzymes such as galactose oxidase(s) (GO), galactose permease(s), galactose kinase(s), and galactose phosphorylase(s). D-Gal is used in the study of Maillard glycation and its consequences in vivo.
Sigma Aldrich - G0625 external link
包装
1 kg in poly bottle
100, 500 g in poly bottle
5 kg in poly drum
Sigma Aldrich - G0750 external link
包装
10 mg in autosmp vl

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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