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(Q104396738)
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4-O-Galloylquinic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1,3,5-trihydroxy-4-(3,4,5-trihydroxybenzoyloxy)cyclohexane-1-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
344.074346712
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,3R,4S,5R)-1,3,5-trihydroxy-4-(3,4,5-trihydroxybenzoyloxy)cyclohexane-1-carboxylic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₆O₁₀
0 references
canonical SMILES
O=C(O)C1(O)CC(O)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1
0 references
isomeric SMILES
O=C(OC1[C@H](O)CC(O)(C(=O)O)C[C@H]1O)c1cc(O)c(O)c(O)c1
0 references
found in taxon
Macaranga tanarius
1 reference
stated in
Tannins and related compounds. XCIV. Isolation and characterization of seven new hydrolyzable tannins from the leaves of Macaranga tanarius (L.) Muell. et Arg.
Phyllanthus amarus
1 reference
stated in
Amariinic acid and related ellagitannins from Phyllanthus amarus
Geranium thunbergii
1 reference
stated in
Elaeocarpusin, a proto-type of geraniin from Geranium thunbergii.
Chinese peony
2 references
stated in
Paeonianins A-E, new dimeric and monomeric ellagitannins from the fruits of Paeonia lactiflora
stated in
Whole transverse section and specific-tissue analysis of secondary metabolites in seven different grades of root of Paeonia lactiflora using laser microdissection and liquid chromatography-quadrupole/time of flight-mass spectrometry
Quercus myrsinaefolia
1 reference
stated in
Gallic acid esters of proto-quercitol, quinic acid and (−)-shikimic acid from quercus mongolica and q. myrsin aefolia
Quercus salicina
1 reference
stated in
Seven quinic acid gallates from quercus stenophylla
Identifiers
InChI
InChI=1S/C14H16O10/c15-6-1-5(2-7(16)10(6)19)12(20)24-11-8(17)3-14(23,13(21)22)4-9(11)18/h1-2,8-9,11,15-19,23H,3-4H2,(H,21,22)/t8-,9-,11?,14?/m1/s1
0 references
InChIKey
OGYBSNRRBNHPNK-LPSXRXAPSA-N
0 references
PubChem CID
475263
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OGYBSNRRBNHPNK-LPSXRXAPSA-N
UniChem compound ID
64432138
1 reference
stated in
UniChem
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