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(Q105149355)
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Tetraneurin C
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[9-(acetyloxy)-6a-hydroxy-6-methyl-3-methylidene-2-oxo-octahydroazuleno[4,5-b]furan-9a-yl]methyl acetate
1 reference
based on heuristic
inferred from SMILES
mass
366.167853172
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆O₇
0 references
canonical SMILES
O=C1OC2C(C1=C)CCC(C)C3(O)CCC(OC(=O)C)C23COC(=O)C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2[C@H]1CC[C@H](C)[C@]1(O)CC[C@H](OC(C)=O)[C@@]21COC(C)=O
0 references
found in taxon
Parthenium alpinum
1 reference
stated in
Tetraneurin-B, -C and -D, new C14-oxygenated pseudoguaianolides from Parthenium (compositae)
Parthenium lozanianum
2 references
stated in
Tetraneurin-B, -C and -D, new C14-oxygenated pseudoguaianolides from Parthenium (compositae)
stated in
Ambrosanolides from parthenium lozanianum
Parthenium fruticosum
2 references
stated in
Pseudoguaianolides from Parthenium fruticosum
stated in
Pseudoguaianolides from Parthenium fruticosum
Parthenium hysterophorus
1 reference
stated in
Dihydroparthenin, a pseudoguaianolide from tissue culture of Parthenium hysterophorus
Identifiers
InChI
InChI=1S/C19H26O7/c1-10-5-6-14-11(2)17(22)26-16(14)18(9-24-12(3)20)15(25-13(4)21)7-8-19(10,18)23/h10,14-16,23H,2,5-9H2,1,3-4H3/t10-,14-,15-,16+,18-,19+/m0/s1
0 references
InChIKey
LBJJWDIRTIPLHE-UKEKVWLUSA-N
0 references
PubChem CID
101306774
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LBJJWDIRTIPLHE-UKEKVWLUSA-N
UniChem compound ID
97532284
1 reference
stated in
UniChem
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