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(Q105217911)
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English
9-(3-Chloro-2-hydroxy-3-methylbutoxy)-4-hydroxyfuro[3,2-g]chromen-7-one
group of stereoisomers with the chemical formula C₁₆H₁₅ClO₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
furanocoumarin
1 reference
inferred from
furanocoumarin
mass
338.05571588
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₅ClO₆
0 references
canonical SMILES
O=C1OC2=C(OCC(O)C(Cl)(C)C)C=3OC=CC3C(O)=C2C=C1
0 references
Identifiers
InChI
InChI=1S/C16H15ClO6/c1-16(2,17)10(18)7-22-15-13-9(5-6-21-13)12(20)8-3-4-11(19)23-14(8)15/h3-6,10,18,20H,7H2,1-2H3
0 references
InChIKey
QBLSTTSBKVLODD-UHFFFAOYSA-N
0 references
PubChem CID
163018264
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QBLSTTSBKVLODD-UHFFFAOYSA-N
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