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English
(5R)-5-methyl-5-[(E,3R)-6-oxo-3-propan-2-ylhept-1-enyl]oxolan-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-(3-isopropyl-6-oxohept-1-en-1-yl)-5-methyloxolan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
252.172544628
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(5R)-5-methyl-5-[(E,3S)-6-oxo-3-propan-2-ylhept-1-enyl]oxolan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄O₃
0 references
canonical SMILES
O=C1OC(C=CC(CCC(=O)C)C(C)C)(C)CC1
0 references
isomeric SMILES
CC(=O)CC[C@@H](/C=C/[C@@]1(C)CCC(=O)O1)C(C)C
0 references
found in taxon
Nicotiana tabacum
1 reference
stated in
A chemical study of burley tobacco flavour (nicotiana tabacumL.) VI. Identification and Synthesis of Four Irregular Terpenoids Related to Solanone, Including a ‘Prenylsolanone’
Identifiers
InChI
InChI=1S/C15H24O3/c1-11(2)13(6-5-12(3)16)7-9-15(4)10-8-14(17)18-15/h7,9,11,13H,5-6,8,10H2,1-4H3/b9-7+/t13-,15-/m0/s1
0 references
InChIKey
VNIPCLUJYQFEPB-VYPOOZAYSA-N
0 references
PubChem CID
162907183
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VNIPCLUJYQFEPB-VYPOOZAYSA-N
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