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(Q105226618)
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English
(6a-hydroxy-6-methyl-3-methylidene-2,9-dioxo-4,5,6,7,8,9b-hexahydro-3aH-azuleno[4,5-b]furan-9a-yl)methyl acetate
group of stereoisomers with the chemical formula C₁₇H₂₂O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
pseudoguaiane sesquiterpenoid
1 reference
inferred from
pseudoguaiane sesquiterpenoid
mass
322.141638424
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₂O₆
0 references
canonical SMILES
O=C1OC2C(C1=C)CCC(C)C3(O)CCC(=O)C23COC(=O)C
0 references
found in taxon
Parthenium fruticosum
1 reference
stated in
Tetraneurin-B, -C and -D, new C14-oxygenated pseudoguaianolides from Parthenium (compositae)
Parthenium alpinum
1 reference
stated in
Tetracyclic triterpenes from Parthenium fruticosum
Parthenium lozanianum
1 reference
stated in
Tetracyclic triterpenes from Parthenium fruticosum
Identifiers
InChI
InChI=1S/C17H22O6/c1-9-4-5-12-10(2)15(20)23-14(12)16(8-22-11(3)18)13(19)6-7-17(9,16)21/h9,12,14,21H,2,4-8H2,1,3H3
0 references
InChIKey
QRTSCMLACFOJIC-UHFFFAOYSA-N
0 references
PubChem CID
162961335
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QRTSCMLACFOJIC-UHFFFAOYSA-N
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