4-O-Acetyl Caffeic Acid Methyl Ester 3-O-(Tri-O-acetyl-Beta-D-glucuronic Acid Methyl Ester)
Product Code
TRC-A171800
Product Format
Neat
Molecular Formula
C25H28O14
Molecular Weight
552.49
Product Categories
Product Type
Stable Isotope LabelledPrice and availability
Product Information
Product Data
Analyte Name
4-O-Acetyl Caffeic Acid Methyl Ester 3-O-(Tri-O-acetyl-beta-D-glucuronic Acid Methyl Ester)
Molecular Formula
C25H28O14
Molecular Weight
552.49
Accurate Mass
552.15
SMILES
O=C(OC)/C=C/C1=CC(O[C@@H]2O[C@H](C(OC)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)=C(OC(C)=O)C=C1
InChI
InChI=1S/C25H28O14/c1-12(26)34-17-9-7-16(8-10-19(30)32-5)11-18(17)38-25-23(37-15(4)29)21(36-14(3)28)20(35-13(2)27)22(39-25)24(31)33-6/h7-11,20-23,25H,1-6H3/b10-8+/t20-,21-,22-,23+,25+/m0/s1
IUPAC
(2S,3R,4S,5S,6S)-2-(2-acetoxy-5-((E)-3-methoxy-3-oxoprop-1-en-1-yl)phenoxy)-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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