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D- (+) -Trehalose-13C12

CAT: 0804-HY-W768345-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W768345-01Size:1 mg
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Description
D- (+) -Trehalose-13C12 is a 13C isotope labeled version of D- (+) -Trehalose. D- (+) -Trehalose, which is widespread, can be used as a food ingredient and pharmaceutical excipient[1].
CAS Number
1313730-07-2
Product Name Alternative
D-Trehalose-13C12; α, α-Trehalose-13C12
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Endogenous Metabolite; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Metabolic Enzyme/Protease; Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/d-plus-trehalose-13c12.html
Purity
99.9
Smiles
O[13CH2][13C@H]([13C@H]([13C@@H]([13C@H]1O)O)O)O[13C@@H]1O[13C@H]2O[13C@@H]([13C@H]([13C@@H]([13C@H]2O)O)O)[13CH2]O
Molecular Formula
13C12H22O11
Molecular Weight
354.21
Precautions
H302, H315, H319, H335
References & Citations
[1]Megarry A J, et al. Amorphous trehalose dihydrate by cryogenic milling[J]. Carbohydrate research, 2011, 346 (8) : 1061-1064.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C (Powder, protect from light, stored under nitrogen)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

D-(+)-Trehalose-13C12
CAS Number1313730-07-2
PubChem CID71309828
IUPAC Name(2R,3S,4S,5R,6R)-2-(hydroxy(113C)methyl)-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxy(113C)methyl)(2,3,4,5,6-13C5)oxan-2-yl]oxy(2,3,4,5,6-13C5)oxane-3,4,5-triol
Molecular FormulaC12H22O11
Molecular Weight354.21
XLogP-4.2
Topological Polar Surface Area190
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity348
SMILES
[13CH2]([13C@@H]1[13C@H]([13C@@H]([13C@H]([13C@H](O1)O[13C@@H]2[13C@@H]([13C@H]([13C@@H]([13C@H](O2)[13CH2]O)O)O)O)O)O)O)O
InChI
InChI=1S/C12H22O11/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/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1
InChIKey
HDTRYLNUVZCQOY-OSKVYJSUSA-N
Chemical Structure
2D Structure
2D structure of D-(+)-Trehalose-13C12
CAS: 1313730-07-2
CID: 71309828
Formula: C12H22O11
MW: 354.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.21
XLogP3-4.2
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Exact Mass354.15646954
Monoisotopic Mass354.15646954
Topological Polar Surface Area190 Ų
Heavy Atom Count23
Formal Charge0
Complexity348
Isotope Atom Count12
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-474787Bα, α-[UL-13C12]Trehalose
CS-OC-00490D-Trehalose-13C12
T201833-01D- (+) -Trehalose-13C12
sc-474790α, β-[UL-13C12]Trehalose
TRC-T718703-1MGAlpha,Beta-Trehalose-13C12
TRC-T718702-1MGAlpha,Alpha-[UL-13C12]Trehalose
B7916-100Trehalose
JH355677α, β-Trehalose
OR1036644A, ß-Trehalose
MT04989-01β, β-Trehalose

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