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(Q105213048)
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English
(4R)-4-hydroxy-4-(2-hydroxypropan-2-yl)cyclohex-2-en-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-hydroxy-4-(2-hydroxypropan-2-yl)cyclohex-2-en-1-one
1 reference
based on heuristic
inferred from SMILES
mass
170.094294308
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₄O₃
0 references
canonical SMILES
O=C1C=CC(O)(CC1)C(O)(C)C
0 references
isomeric SMILES
CC(C)(O)[C@]1(O)C=CC(=O)CC1
0 references
found in taxon
Hydrocotyle leucocephala
1 reference
stated in
Immunosuppressive diacetylenes, ceramides and cerebrosides from Hydrocotyle leucocephala
Identifiers
InChI
InChI=1S/C9H14O3/c1-8(2,11)9(12)5-3-7(10)4-6-9/h3,5,11-12H,4,6H2,1-2H3/t9-/m0/s1
0 references
InChIKey
PPUIVANKQVBONX-VIFPVBQESA-N
0 references
PubChem CID
162878501
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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