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(Q105256230)
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English
Americanoicacidmethylester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Methyl 2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
332.089602852
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₆O₇
0 references
canonical SMILES
O=C(OC)C1=CC=C2OC(C3=CC=C(O)C(O)=C3)C(OC2=C1)CO
0 references
isomeric SMILES
COC(=O)c1ccc2c(c1)O[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2
0 references
found in taxon
Phytolacca americana
1 reference
stated in
Structures of 1,4-benzodioxane derivatives from the seeds of Phytolacca americana and their neuritogenic activity in primary cultured rat cortical neurons
Identifiers
InChI
InChI=1S/C17H16O7/c1-22-17(21)10-3-5-13-14(7-10)23-15(8-18)16(24-13)9-2-4-11(19)12(20)6-9/h2-7,15-16,18-20H,8H2,1H3/t15-,16-/m0/s1
0 references
InChIKey
SMXSVGZXCWSPEI-HOTGVXAUSA-N
0 references
PubChem CID
11198348
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SMXSVGZXCWSPEI-HOTGVXAUSA-N
UniChem compound ID
32294726
1 reference
stated in
UniChem
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