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(Q82658843)
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English
Methyl 3-[3-methoxy-4-(sulfooxy)phenyl]prop-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkyl caffeate ester
0 references
mass
288.030373724
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₂O₇S
0 references
canonical SMILES
O=C(OC)C=CC1=CC=C(OS(=O)(=O)O)C(OC)=C1
0 references
found in taxon
Tamarix nilotica
1 reference
stated in
A new ferulic acid ester and other constituents from Tamarix nilotica leaves.
Tamarix senegalensis
1 reference
stated in
A new ferulic acid ester and other constituents from Tamarix nilotica leaves.
Identifiers
InChI
InChI=1S/C11H12O7S/c1-16-10-7-8(4-6-11(12)17-2)3-5-9(10)18-19(13,14)15/h3-7H,1-2H3,(H,13,14,15)
0 references
InChIKey
BYHNTXKLKDHSRP-UHFFFAOYSA-N
0 references
CAS Registry Number
651705-78-1
0 references
PubChem CID
57074595
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
BYHNTXKLKDHSRP-UHFFFAOYSA-N
UniChem compound ID
50483625
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20720233
1 reference
matched by identifier from
InChIKey
InChIKey
BYHNTXKLKDHSRP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90670978
0 references
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