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Dopegal

CAT: 0013-GTR19274740-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19274740-02Size:10 mg
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Description
Dopegal is a metabolite of norepinephrine. It activates aspartate endopeptidases and promotes pathological tau protein aggregation in the locus coeruleus.
CAS Number
13023-73-9
Smiles
O=CC (O) C1=CC=C (O) C (O) =C1
Molecular Formula
C8H8O4
Molecular Weight
168.15
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

alpha,3,4-Trihydroxybenzeneacetaldehyde

3,4-dihydroxymandelaldehyde is a hydroxyaldehyde consisting of phenylacetaldehyde having three hydroxy substituents located at the alpha-, 3- and 4-positions. It is a metabolite of noradrenaline. It has a role as a neurotoxin, a mouse metabolite and a human metabolite. It is a member of catechols and a hydroxyaldehyde.

CAS Number13023-73-9
PubChem CID151725
IUPAC Name2-(3,4-dihydroxyphenyl)-2-hydroxyacetaldehyde
Molecular FormulaC8H8O4
Molecular Weight168.15
XLogP-0.6
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity159
SMILES
C1=CC(=C(C=C1C(C=O)O)O)O
InChI
InChI=1S/C8H8O4/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-4,8,10-12H
InChIKey
YUGMCLJIWGEKCK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of alpha,3,4-Trihydroxybenzeneacetaldehyde
CAS: 13023-73-9
CID: 151725
Formula: C8H8O4
MW: 168.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight168.15
XLogP3-0.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass168.04225873
Monoisotopic Mass168.04225873
Topological Polar Surface Area77.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity159
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19190555-01DOPAL

Alternative Products

CatalogName
TRC-D454655-5MG3,4-Dihydroxyphenylglycolaldehyde (Dopegal)

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