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(Q104393483)
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English
5-O-Feruloylquinic acid
group of stereoisomers with the chemical formula C₁₇H₂₀O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
alkyl caffeate ester
1 reference
inferred from
alkyl caffeate ester
mass
368.11073222
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₀O₉
0 references
canonical SMILES
O=C(OC1CC(O)(C(=O)O)CC(O)C1O)C=CC2=CC=C(O)C(OC)=C2
0 references
found in taxon
Coffea arabica
1 reference
stated in
Chlorogenic acid composition of instant coffees
Angelica taiwaniana
1 reference
stated in
Inhibitors of nitric oxide production from the flowers of Angelica furcijuga: structures of hyuganosides IV and V.
Artemisia annua
1 reference
stated in
Characterization of phenolic compounds in the Chinese herbal drug Artemisia annua by liquid chromatography coupled to electrospray ionization mass spectrometry
potato
1 reference
stated in
Solving the jigsaw puzzle of wound-healing potato cultivars: metabolite profiling and antioxidant activity of polar extracts
Identifiers
InChI
InChI=1S/C17H20O9/c1-25-12-6-9(2-4-10(12)18)3-5-14(20)26-13-8-17(24,16(22)23)7-11(19)15(13)21/h2-6,11,13,15,18-19,21,24H,7-8H2,1H3,(H,22,23)
0 references
InChIKey
RAGZUCNPTLULOL-UHFFFAOYSA-N
0 references
PubChem CID
73210496
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
70502775
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR309019
1 reference
InChIKey
RAGZUCNPTLULOL-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR309021
1 reference
InChIKey
RAGZUCNPTLULOL-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR311017
1 reference
InChIKey
RAGZUCNPTLULOL-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PM000309
1 reference
InChIKey
RAGZUCNPTLULOL-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
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