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Caffeic acid 4-O-glucoside

CAT: 1410-M32327-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Caffeic acid 4-O-glucoside showed significant axonal elongation effects on Aβ25-35-induced atrophy.
CAS Number
166735-99-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
342.3
Molecular Formula
C15H18O9
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

3-(3-Hydroxy-4-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)acrylic acid
CAS Number166735-99-5
PubChem CID162989109
IUPAC Name3-[3-hydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid
Molecular FormulaC15H18O9
Molecular Weight342.30
XLogP-1.4
Topological Polar Surface Area157
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity454
SMILES
C1=CC(=C(C=C1C=CC(=O)O)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChI
InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/t10-,12-,13+,14-,15+/m1/s1
InChIKey
OHEYCHKLBCPRLZ-LFHLZQBKSA-N
Chemical Structure
2D Structure
2D structure of 3-(3-Hydroxy-4-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)acrylic acid
CAS: 166735-99-5
CID: 162989109
Formula: C15H18O9
MW: 342.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.30
XLogP3-1.4
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass342.09508215
Monoisotopic Mass342.09508215
Topological Polar Surface Area157 Ų
Heavy Atom Count24
Formal Charge0
Complexity454
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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