Dihydro Caffeic Acid 3-O-Sulfate Sodium Salt
Product Code
TRC-D448710
CAS Number
Product Format
Neat
Molecular Formula
C9H8Na2O7S
Molecular Weight
306.20
Product Categories
Product Type
MetaboliteAlternate CAS Number
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
Dihydro Caffeic Acid 3-O-Sulfate Sodium Salt
CAS Number
1187945-70-5
Molecular Formula
C9H8Na2O7S
Molecular Weight
306.20
Accurate Mass
305.979
SMILES
C1=CC(=C(C=C1CCC(=O)[O-])OS(=O)(=O)[O-])O.[Na+].[Na+]
InChI
InChI=1S/C9H10O7S.2Na/c10-7-3-1-6(2-4-9(11)12)5-8(7)16-17(13,14)15;;/h1,3,5,10H,2,4H2,(H,11,12)(H,13,14,15);;/q;2*+1/p-2
IUPAC
disodium;3-(4-hydroxy-3-sulfonatooxyphenyl)propanoate
Alternate CAS Number
Free acid: 1187945-70-5
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
Purity
>95% (HPLC)
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