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(Q104921913)
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English
(2S,3S)-3-(3,5-Dimethoxy-4-hydroxyphenyl)-6-[(E)-3-hydroxy-1-propenyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2-methanol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
CID 85162038
1 reference
based on heuristic
inferred from SMILES
mass
404.147117728
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
4-[(2R,3R)-3-(hydroxymethyl)-7-[(1E)-3-hydroxyprop-1-en-1-yl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-2-yl]-2,6-dimethoxyphenol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₄O₈
0 references
canonical SMILES
OC1=C(OC)C=C(C=C1OC)C2OC3=CC(C=CCO)=CC(OC)=C3OC2CO
0 references
isomeric SMILES
COc1cc([C@@H]2Oc3cc(/C=C/CO)cc(OC)c3O[C@H]2CO)cc(OC)c1O
0 references
found in taxon
Grewia bilamellata
1 reference
stated in
Antimalarial compounds from Grewia bilamellata.
Santalum album
2 references
stated in
Aromatic constituents from the heartwood of Santalum album L
stated in
Lignans from Santalum album and their cytotoxic activities
Zanthoxylum nitidum
1 reference
stated in
Studies on the Chemical Constituents of Xanthoxylum nitidum (Roxb.) D. C. (Fagara nitida Roxb.). III. The Chemical Constituents of the Wood.
Identifiers
InChI
InChI=1S/C21H24O8/c1-25-14-9-13(10-15(26-2)19(14)24)20-18(11-23)29-21-16(27-3)7-12(5-4-6-22)8-17(21)28-20/h4-5,7-10,18,20,22-24H,6,11H2,1-3H3/b5-4+/t18-,20-/m0/s1
0 references
InChIKey
AZTAGXIJLPKJOR-BJUCQYRTSA-N
0 references
PubChem CID
11188887
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AZTAGXIJLPKJOR-BJUCQYRTSA-N
UniChem compound ID
235387
1 reference
stated in
UniChem
NMRShiftDB structure ID
10028047
1 reference
matched by identifier from
InChIKey
InChIKey
AZTAGXIJLPKJOR-BJUCQYRTSA-N
KNApSAcK ID
C00063219
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AZTAGXIJLPKJOR-BJUCQYRTSA-N
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