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Trehalose C14

CAT: 0013-GTR19247981-03Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19247981-03Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Trehalose C14 is a surfactant.
CAS Number
64622-92-0
Field of Research
Signal Transduction
Smiles
CCCCCCCCCCCCCC (OC[C@H] ([C@H] ([C@@H] ([C@H]1O) O) O) O[C@@H]1O[C@H]2O[C@@H] ([C@H] ([C@@H] ([C@H]2O) O) O) CO) =O
Molecular Formula
C26H48O12
Molecular Weight
552.65
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Trehalose C14
CAS Number64622-92-0
PubChem CID101218985
IUPAC Name[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl tetradecanoate
Molecular FormulaC26H48O12
Molecular Weight552.7
XLogP2.1
Topological Polar Surface Area196
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count18
Heavy Atom Count38
Formal Charge0
Complexity652
SMILES
CCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O
InChI
InChI=1S/C26H48O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-18(28)35-15-17-20(30)22(32)24(34)26(37-17)38-25-23(33)21(31)19(29)16(14-27)36-25/h16-17,19-27,29-34H,2-15H2,1H3/t16-,17-,19-,20-,21+,22+,23-,24-,25-,26-/m1/s1
InChIKey
LRXBVTKVELRWDT-MPBWFABASA-N
Chemical Structure
2D Structure
2D structure of Trehalose C14
CAS: 64622-92-0
CID: 101218985
Formula: C26H48O12
MW: 552.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight552.7
XLogP32.1
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count18
Exact Mass552.31457696
Monoisotopic Mass552.31457696
Topological Polar Surface Area196 Ų
Heavy Atom Count38
Formal Charge0
Complexity652
Isotope Atom Count0
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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