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(Q105208505)
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Qianhucoumarin E
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8,8-dimethyl-2,10-dioxo-9H-pyrano[2,3-h]chromen-9-yl (2E)-2-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
(8,8-dimethyl-2,10-dioxo-9H-pyrano[2,3-f]chromen-9-yl) 2-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
mass
342.110338296
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(9S)-8,8-dimethyl-2,10-dioxo-9H-pyrano[2,3-f]chromen-9-yl] (Z)-2-methylbut-2-enoate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₁₈O₆
0 references
canonical SMILES
O=C1OC2=C(C=C1)C=CC=3OC(C)(C)C(OC(=O)C(=CC)C)C(=O)C32
0 references
isomeric SMILES
C/C=C(\C)C(=O)O[C@H]1C(=O)c2c(ccc3ccc(=O)oc23)OC1(C)C
0 references
found in taxon
Kitagawia praeruptora
1 reference
stated in
Coumarins from Peucedanum praeruptorum
Identifiers
InChI
InChI=1S/C19H18O6/c1-5-10(2)18(22)24-17-15(21)14-12(25-19(17,3)4)8-6-11-7-9-13(20)23-16(11)14/h5-9,17H,1-4H3/b10-5+/t17-/m0/s1
0 references
InChIKey
PGOMXBOHQUBUMI-HQWZXOHUSA-N
0 references
PubChem CID
131676021
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PGOMXBOHQUBUMI-HQWZXOHUSA-N
UniChem compound ID
153364795
1 reference
stated in
UniChem
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