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(Q76534928)
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English
(E)-1-(2,4-dihydroxyphenyl)-3-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chalcone
1 reference
based on heuristic
inferred from SMILES
mass
448.13694696799985
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(E)-1-(2,4-dihydroxyphenyl)-3-[3-methoxy-4-[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₄O₁₀
0 references
canonical SMILES
COc1cc(C=CC(=O)c2ccc(O)cc2O)ccc1OC1OC(CO)C(O)C(O)C1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC1=C(C=CC(=C1)/C=C/C(=O)C2=C(C=C(C=C2)O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
0 references
Identifiers
InChI
InChI=1S/C22H24O10/c1-30-17-8-11(2-6-14(25)13-5-4-12(24)9-15(13)26)3-7-16(17)31-22-21(29)20(28)19(27)18(10-23)32-22/h2-9,18-24,26-29H,10H2,1H3/b6-2+/t18-,19-,20+,21-,22-/m1/s1
0 references
InChIKey
GGEYANQDEGRTLH-MTZONIEDSA-N
0 references
PubChem CID
42607545
1 reference
matched by identifier from
InChIKey
InChIKey
GGEYANQDEGRTLH-MTZONIEDSA-N
UniChem compound ID
47473320
1 reference
stated in
UniChem
LIPID MAPS ID
LMPK12120104
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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