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(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-3,4,5-triol dihydrate
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ChemBase ID:
102800
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Molecular Formular:
C12H26O13
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Molecular Mass:
378.32704
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Monoisotopic Mass:
378.13734089
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SMILES and InChIs
SMILES:
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)O.O.O
Canonical SMILES:
OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O.O.O
InChI:
InChI=1S/C12H22O11.2H2O/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12;;/h3-20H,1-2H2;2*1H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-;;/m1../s1
InChIKey:
DPVHGFAJLZWDOC-PVXXTIHASA-N
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Cite this record
CBID:102800 http://www.chembase.cn/molecule-102800.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-3,4,5-triol dihydrate
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IUPAC Traditional name
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Synonyms
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α,α-Trehalose
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α-D-Glucopyranosyl-α-D-glucopyranoside
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α,α-Trehalose
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1-O-α-D-Gluco-pyranosyl-α-D-glucopyranoside
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D-(+)-TREHALOSE DIHYDRATE
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D-(+)-Trehalose dihydrate
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Mycose,1-O-α-D-glucopyranosyl-α-D-glucopyranoside
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α,α-海藻糖
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α-D-吡喃葡萄糖基-α-D-吡喃葡萄糖苷
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D-(+)-海藻糖 二水合物
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CAS Number
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EC Number
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MDL Number
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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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11.905896
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H Acceptors
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11
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H Donor
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8
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LogD (pH = 5.5)
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-4.703375
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LogD (pH = 7.4)
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-4.703388
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Log P
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-4.703375
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Molar Refractivity
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68.3367 cm3
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Polarizability
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28.969793 Å3
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Polar Surface Area
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189.53 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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false
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DETAILS
DETAILS
MP Biomedicals
Sigma Aldrich
Sigma Aldrich -
T3663
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Application Trehalose is used in cryobiology to improve the viability and recovery of plant cells exposed to dehydration and freezing/thawing. |
Sigma Aldrich -
T9531
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包装 10 mg in autosmp vl 2.5, 25 kg in poly drum 5, 10, 25, 100, 500 g in poly bottle Preparation Note 通过离子交换色谱制备。 Quality 金属离子含量低。 |
Sigma Aldrich -
T5251
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Preparation Note Prepared by the modified procedure of Payen, R., Can. J. Res., 27B, 749 (1949). |
Sigma Aldrich -
T0167
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Frequently Asked Questions Live Chat and Frequently Asked Questions are available for this Product. Application Use as a cryoprotectant in a variety of cell freezing media. |
Sigma Aldrich -
90208
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Preparation Note The metal ion content is reduced by ion exchange chromatography. |
PATENTS
PATENTS
PubChem Patent
Google Patent