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(Q104393560)
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English
(8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-9-yl) (E)-2-methylbut-2-enoate
group of stereoisomers with the chemical formula C₁₉H₂₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
328.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₀O₅
0 references
canonical SMILES
O=C1OC2=C(C=C1)C=CC=3OC(C)(C)C(OC(=O)C(=CC)C)CC32
0 references
isomeric SMILES
C/C=C(\C)C(=O)OC1Cc2c(ccc3ccc(=O)oc23)OC1(C)C
1 reference
based on heuristic
inferred from InChI
found in taxon
Peucedanum japonicum
1 reference
stated in
Coumarins and antiplatelet aggregation constituents from Formosan Peucedanum japonicum
Identifiers
InChI
InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5+
0 references
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-N
0 references
PubChem CID
5367834
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-N
UniChem compound ID
66168427
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN_NPDepo-CB000231
1 reference
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA00385
1 reference
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA00386
1 reference
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA00387
1 reference
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA00388
1 reference
InChIKey
RRHCDWLSHIIIIT-VZUCSPMQSA-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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