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(Q104996390)
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English
(R)-[(3R,4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]-(3,4-dimethoxyphenyl)methanol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[5-(1,3-Benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]-(3,4-dimethoxyphenyl)methanol
1 reference
based on heuristic
inferred from SMILES
mass
388.152203108
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₄O₇
0 references
canonical SMILES
OCC1C(OCC1C(O)C2=CC=C(OC)C(OC)=C2)C3=CC=C4OCOC4=C3
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isomeric SMILES
COc1ccc([C@H](O)[C@H]2CO[C@H](c3ccc4c(c3)OCO4)[C@H]2CO)cc1OC
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found in taxon
Magnolia denudata
1 reference
stated in
Lignan and neolignan derivatives from Magnolia denudata
Identifiers
InChI
InChI=1S/C21H24O7/c1-24-16-5-3-12(7-18(16)25-2)20(23)15-10-26-21(14(15)9-22)13-4-6-17-19(8-13)28-11-27-17/h3-8,14-15,20-23H,9-11H2,1-2H3/t14-,15-,20-,21+/m0/s1
0 references
InChIKey
FJXKIGDEXMHOCZ-LATRNWQMSA-N
0 references
PubChem CID
162938001
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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