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(2R,3S,4R)-2,3,4,5-tetrahydroxypentanal
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ChemBase ID:
72841
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Molecular Formular:
C5H10O5
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Molecular Mass:
150.1299
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Monoisotopic Mass:
150.05282342
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SMILES and InChIs
SMILES:
OC[C@H]([C@@H]([C@H](C=O)O)O)O
Canonical SMILES:
OC[C@H]([C@@H]([C@H](C=O)O)O)O
InChI:
InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4+,5+/m0/s1
InChIKey:
PYMYPHUHKUWMLA-VPENINKCSA-N
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Cite this record
CBID:72841 http://www.chembase.cn/molecule-72841.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2R,3S,4R)-2,3,4,5-tetrahydroxypentanal
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IUPAC Traditional name
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Synonyms
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D-Xylose
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Xylose
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Wood sugar
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D-(+)-XYLOSE
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DL-Xylose
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(2R,3S,4R)-2,3,4,5-tetrahydroxypentanal
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DL-木糖
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CAS Number
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EC Number
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MDL Number
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MFCD00151475
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MFCD00198055
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Beilstein Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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12.332793
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H Acceptors
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5
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H Donor
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4
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LogD (pH = 5.5)
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-2.9380257
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LogD (pH = 7.4)
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-2.9380307
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Log P
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-2.9380257
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Molar Refractivity
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31.3831 cm3
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Polarizability
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12.73608 Å3
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Polar Surface Area
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97.99 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
MP Biomedicals
Selleck Chemicals
Selleck Chemicals -
S2124
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Research Area: Metabolic Disease Biological Activity: Xylose is a sugar first isolated from wood. Xylose is classified as a monosaccharide of the aldopentose type, which means that it contains five carbon atoms and includes an aldehyde functional group. It is the precursor to hemicellulose, one of the main constituents of biomass. Like most sugars, it can adopt several structures depending on conditions. With its free carbonyl group, it is a reducing sugar. [1] |
PATENTS
PATENTS
PubChem Patent
Google Patent