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(Q105141189)
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English
3-[(2E,6S)-6-hydroperoxy-3,7-dimethylocta-2,7-dienyl]-4-hydroxybenzaldehyde
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-(6-Hydroperoxy-3,7-dimethylocta-2,7-dienyl)-4-hydroxybenzaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
290.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₂O₄
0 references
canonical SMILES
O=CC1=CC=C(O)C(=C1)CC=C(C)CCC(OO)C(=C)C
0 references
isomeric SMILES
C=C(C)[C@H](CC/C(C)=C/Cc1cc(C=O)ccc1O)OO
0 references
found in taxon
Philotheca myoporoides
2 references
stated in
Pyranocoumarins as chemotaxonomic markers in Eriostemon coccineus and Philotheca citrina
stated in
Sesquiterpenyl coumarins and geranyl benzaldehyde derivatives from the aerial parts of Eriostemon myoporoides
Identifiers
InChI
InChI=1S/C17H22O4/c1-12(2)17(21-20)9-5-13(3)4-7-15-10-14(11-18)6-8-16(15)19/h4,6,8,10-11,17,19-20H,1,5,7,9H2,2-3H3/b13-4+/t17-/m0/s1
0 references
InChIKey
KHKQLELQCHPMMI-UEIWYUPXSA-N
0 references
PubChem CID
163194285
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KHKQLELQCHPMMI-UEIWYUPXSA-N
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