1-O-Caffeoylglucose - CAS 14364-08-0

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Catalog Number: M131064

CAS Number: 14364-08-0

PubChem Substance ID:355145741

Molecular Formula: C15H18O9

Molecular Weight:342.3

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

Synonymsb-D-Glucopyranose, 1-[3-(3,4-dihydroxyphenyl)-2-propenoate]

Property

Molecular Formula: C15H18O9
Molecular Weight342.3
Purity≥95%
Storage-80°C

Computed Descriptor

IUPAC Name[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChIInChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1
InChIKeyWQSDYZZEIBAPIN-VBQORRLJSA-N
SMILESC1=CC(=C(C=C1C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O)O)O