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(Q105146091)
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English
(2S,3S,4S,5R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxyoxane-3,4,5-triol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavylium compound
0 references
mass
419.09727322809
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2R,3R,4R,5S)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxyoxane-3,4,5-triol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
cyanidin 3-arabinoside cation
1 reference
based on heuristic
inferred from InChI
KUCVMQMKRICXJC-FEUVXWNVSA-O
1 reference
based on heuristic
inferred from InChI
3-beta-D-Arabinopyranosyloxy-5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-1-benzopyrylium
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₉O₁₀⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
OC=1C=C(O)C=2C=C(OC3OCC(O)C(O)C3O)C(=[O+]C2C1)C=4C=CC(O)=C(O)C4
0 references
isomeric SMILES
Oc1cc(O)c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@@H]3O)c(-c3ccc(O)c(O)c3)[o+]c2c1
0 references
found in taxon
Vaccinium padifolium
1 reference
stated in
Anthocyanins in blue berries of Vaccinium padifolium
Identifiers
InChI
InChI=1S/C20H18O10/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24)/p+1/t14-,17+,18+,20+/m1/s1
0 references
InChIKey
KUCVMQMKRICXJC-FBVAEJEDSA-O
0 references
PubChem CID
12098017
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KUCVMQMKRICXJC-FBVAEJEDSA-O
UniChem compound ID
2650925
1 reference
stated in
UniChem
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