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Achillicin
group of stereoisomers with the chemical formula C₁₇H₂₂O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
guaiane sesquiterpenoid
1 reference
inferred from
guaiane sesquiterpenoid
mass
306.146723804
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₂O₅
0 references
canonical SMILES
O=C(OC1CC(O)(C2=CCC(=C2C3OC(=O)C(C)C31)C)C)C
0 references
found in taxon
Achillea millefolium
1 reference
stated in
Chemotypes in Achillea collina based on sesquiterpene lactone profile
Identifiers
InChI
InChI=1S/C17H22O5/c1-8-5-6-11-13(8)15-14(9(2)16(19)22-15)12(21-10(3)18)7-17(11,4)20/h6,9,12,14-15,20H,5,7H2,1-4H3
0 references
InChIKey
ZPTLTKQKVWFFNY-UHFFFAOYSA-N
0 references
PubChem CID
131752003
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ZPTLTKQKVWFFNY-UHFFFAOYSA-N
UniChem compound ID
32005691
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0036487
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZPTLTKQKVWFFNY-UHFFFAOYSA-N
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