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(Q105219903)
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English
(3aS,6E,10Z,11aR)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-10-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6-Methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-10-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
262.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aS,6Z,10E,11aS)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-10-carboxylic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₈O₄
0 references
canonical SMILES
O=C(O)C1=CC2OC(=O)C(=C)C2CCC(=CCC1)C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2/C=C(\C(=O)O)CC/C=C(\C)CC[C@@H]12
0 references
found in taxon
Arctotis revoluta
1 reference
stated in
Sesquiterpene lactones and farnesol derivatives from Arctotis and Aarctotheca species
Koyamasia calcarea
1 reference
stated in
Antiplasmodial, antimycobacterial, and cytotoxic principles from Camchaya calcarea.
Identifiers
InChI
InChI=1S/C15H18O4/c1-9-4-3-5-11(14(16)17)8-13-12(7-6-9)10(2)15(18)19-13/h4,8,12-13H,2-3,5-7H2,1H3,(H,16,17)/b9-4+,11-8-/t12-,13+/m0/s1
0 references
InChIKey
QGBJYBAYHYMEBA-SLJSYBAPSA-N
0 references
PubChem CID
162971726
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QGBJYBAYHYMEBA-SLJSYBAPSA-N
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