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(Q105135983)
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English
[(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(3,4,5,6-Tetrahydroxyoxan-2-yl)methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate
1 reference
based on heuristic
inferred from SMILES
6-O-(E)-Caffeoylglucopyranose
1 reference
based on heuristic
inferred from SMILES
mass
342.095082156
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(E)-3-(3,4-Dihydroxyphenyl)propenoic acid 6-deoxy-beta-D-glucopyranose-6-yl ester
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₈O₉
0 references
canonical SMILES
O=C(OCC1OC(O)C(O)C(O)C1O)C=CC2=CC=C(O)C(O)=C2
0 references
isomeric SMILES
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
0 references
found in taxon
Vitex polygama
1 reference
stated in
Compounds from Vitex polygama active against kidney diseases
Identifiers
InChI
InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1
0 references
InChIKey
JVVFTHAOTNXPOZ-VBQORRLJSA-N
0 references
PubChem CID
162947632
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JVVFTHAOTNXPOZ-VBQORRLJSA-N
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