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(Q105265227)
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English
7,8-dihydroxy-5-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-6-methoxychromen-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic coumarin
0 references
mass
292.094688232
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₆O₆
0 references
canonical SMILES
O=C1OC2=C(O)C(O)=C(OC)C(=C2C=C1)CC=C(C)CO
0 references
isomeric SMILES
COc1c(O)c(O)c2oc(=O)ccc2c1C/C=C(\C)CO
1 reference
based on heuristic
inferred from InChI
found in taxon
Haplophyllum obtusifolium
1 reference
stated in
A study of the coumarins ofHaplophyllum obtusifolium by13C NMR spectroscopy
Identifiers
InChI
InChI=1S/C15H16O6/c1-8(7-16)3-4-9-10-5-6-11(17)21-15(10)13(19)12(18)14(9)20-2/h3,5-6,16,18-19H,4,7H2,1-2H3/b8-3+
0 references
InChIKey
TVDZWFVHDNZOKZ-FPYGCLRLSA-N
0 references
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