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(Q105219078)
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English
2-Hepten-4-one, 2-methyl-6-(4-methyl-3-cyclohexen-1-ylidene)-, (6Z)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
bisabolanes
0 references
mass
218.167065324
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O
0 references
canonical SMILES
O=C(C=C(C)C)CC(=C1CC=C(C)CC1)C
0 references
isomeric SMILES
CC(C)=CC(=O)C/C(C)=C1\CC=C(C)CC1
1 reference
based on heuristic
inferred from InChI
found in taxon
Cedrus libani
1 reference
stated in
Phytochemical analysis and in vitro evaluation of the biological activity against herpes simplex virus type 1 (HSV-1) of Cedrus libani A. Rich
Identifiers
InChI
InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,9H,6-8,10H2,1-4H3/b14-13+
0 references
InChIKey
QEAHSEZXAQIWSW-BUHFOSPRSA-N
0 references
PubChem CID
91698329
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
96647413
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0302608
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QEAHSEZXAQIWSW-BUHFOSPRSA-N
KNApSAcK ID
C00050265
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QEAHSEZXAQIWSW-BUHFOSPRSA-N
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