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(Q105347400)
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English
(3S)-8-hydroxy-3,5-dimethyl-3,4-dihydroisochromen-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-methylmellein
1 reference
based on heuristic
inferred from InChIKey
mass
192.078644244
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
5-methylmellein
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₂O₃
0 references
canonical SMILES
O=C1OC(C)CC2=C1C(O)=CC=C2C
0 references
isomeric SMILES
Cc1ccc(O)c2c1C[C@H](C)OC2=O
0 references
found in taxon
Cytospora eucalypticola
1 reference
stated in
Dihydroisocoumarins and a tetralone from Cytospora eucalypticola
Cytospora eucalypti
1 reference
stated in
Dihydroisocoumarins and a tetralone from Cytospora eucalypticola
Swartzia laevicarpa
1 reference
stated in
Pterocarpans from Swartzia laevicarpa
Identifiers
InChI
InChI=1S/C11H12O3/c1-6-3-4-9(12)10-8(6)5-7(2)14-11(10)13/h3-4,7,12H,5H2,1-2H3/t7-/m0/s1
0 references
InChIKey
YETSBBYQOFXYGV-ZETCQYMHSA-N
0 references
PubChem CID
130638185
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YETSBBYQOFXYGV-ZETCQYMHSA-N
ChEBI ID
200206
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H12O3/c1-6-3-4-9(12)10-8(6)5-7(2)14-11(10)13/h3-4,7,12H,5H2,1-2H3/t7-/m0/s1
UniChem compound ID
162486805
1 reference
stated in
UniChem
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