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Isopentyl b-D-glucoside

CAT: 0931-T126225Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T126225Size:1 mg
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CAS Number
120671-07-0
Target
Others
Related Pathways
Others
Bioactivity
Isopentyl b-D-glucoside is a useful organic compound for research related to life sciences. The catalog number is T126225 and the CAS number is 120671-07-0.
Smiles
CC(C)CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Molecular Formula
C11H22O6
Molecular Weight
250.291
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(3-methylbutoxy)oxane-3,4,5-triol
CAS Number120671-07-0
PubChem CID10848285
IUPAC Name(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(3-methylbutoxy)oxane-3,4,5-triol
Molecular FormulaC11H22O6
Molecular Weight250.29
XLogP-0.5
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity222
SMILES
CC(C)CCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI
InChI=1S/C11H22O6/c1-6(2)3-4-16-11-10(15)9(14)8(13)7(5-12)17-11/h6-15H,3-5H2,1-2H3/t7-,8-,9+,10-,11-/m1/s1
InChIKey
PPOCTRFLRHRTTR-KAMPLNKDSA-N
Chemical Structure
2D Structure
2D structure of (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(3-methylbutoxy)oxane-3,4,5-triol
CAS: 120671-07-0
CID: 10848285
Formula: C11H22O6
MW: 250.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight250.29
XLogP3-0.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass250.14163842
Monoisotopic Mass250.14163842
Topological Polar Surface Area99.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity222
Isotope Atom Count0
Defined Atom Stereocenter Count5
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
GTR19227762Isopentyl b-D-glucoside
GC8307-1mgIsopentyl β-D-glucuronide
BICL2331-01Isopentyl ß-D-glucuronide
GC6339-5mgIsopentyl-d11 β-D-glucuronide
BICL2324-01Isopentyl-d11 ß-D-glucuronide
GRA945152- (Hydroxymethyl) -1-isopentyl-1H-benzo[D]imidazole-5-carbonitrile
294619-01B-Sitosterol b-D-glucoside
TRC-P320865-250MGb-Phenylethyl b-D-Glucoside
Y46362003b-D-Glucoside glycohydrolase
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