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(Q104401630)
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English
Propanoic acid,2-methyl-,[(3aS,6R,6aR,9aS,9bR)-dodecahydro-6a-hydroxy-9a-methyl-3-methylene-2,9-dioxoazuleno[4,5-b]furan-6-yl]-methyl ester
group of stereoisomers with the chemical formula C₁₉H₂₆O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
pseudoguaiane sesquiterpenoid
1 reference
inferred from
pseudoguaiane sesquiterpenoid
mass
350.172938552
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆O₆
0 references
canonical SMILES
O=C1OC2C(C1=C)CCC(COC(=O)C(C)C)C3(O)CCC(=O)C23C
0 references
found in taxon
Parthenium hysterophorus
1 reference
stated in
Sesquiterpene lactone variability in Parthenium hysterophorus L
Identifiers
InChI
InChI=1S/C19H26O6/c1-10(2)16(21)24-9-12-5-6-13-11(3)17(22)25-15(13)18(4)14(20)7-8-19(12,18)23/h10,12-13,15,23H,3,5-9H2,1-2,4H3
0 references
InChIKey
JZSKRTQUAPZFGL-UHFFFAOYSA-N
0 references
PubChem CID
615944
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
JZSKRTQUAPZFGL-UHFFFAOYSA-N
UniChem compound ID
42987492
1 reference
stated in
UniChem
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