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(Q125026961)
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English
7-(3’-carboxybut-2’-enoxy)coumarin
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
370.1780239319999
dalton
1 reference
based on heuristic
inferred from SMILES
370.17802393200003
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₆O₅
0 references
canonical SMILES
O(C=1C=C(C=C(OC)C1OC)C2C3=CC=4OCOC4C=C3CC(C)C2C)C
0 references
isomeric SMILES
COc1cc([C@@H]2c3cc4c(cc3C[C@@H](C)[C@@H]2C)OCO4)cc(OC)c1OC
0 references
found in taxon
Austrobaileya scandens
1 reference
stated in
Some constituents of Austrobaileya scandens (Austrobaileyaceae) : structures of seven new lignans
Identifiers
InChI
InChI=1S/C22H26O5/c1-12-6-14-7-17-18(27-11-26-17)10-16(14)21(13(12)2)15-8-19(23-3)22(25-5)20(9-15)24-4/h7-10,12-13,21H,6,11H2,1-5H3/t12-,13+,21-/m1/s1
0 references
InChIKey
OZZUFLDUPKLHBA-RRMDADRESA-N
0 references
PubChem CID
102117085
2 references
stated in
PubChem
retrieved
26 April 2024
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OZZUFLDUPKLHBA-RRMDADRESA-N
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