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(Q105145586)
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English
6-(3-chloro-2-hydroxy-3-methylbutyl)-7-methoxychromen-2-one
group of stereoisomers with the chemical formula C₁₅H₁₇ClO₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic coumarin
1 reference
inferred from
biogenic coumarin
mass
296.081536704
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₇ClO₄
0 references
canonical SMILES
O=C1OC=2C=C(OC)C(=CC2C=C1)CC(O)C(Cl)(C)C
0 references
Identifiers
InChI
InChI=1S/C15H17ClO4/c1-15(2,16)13(17)7-10-6-9-4-5-14(18)20-12(9)8-11(10)19-3/h4-6,8,13,17H,7H2,1-3H3
0 references
InChIKey
KSTOEGFAGCVBGN-UHFFFAOYSA-N
0 references
PubChem CID
11162279
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KSTOEGFAGCVBGN-UHFFFAOYSA-N
UniChem compound ID
32741283
1 reference
stated in
UniChem
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