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Ligularenolide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
eremophilane sesquiterpenoid
0 references
mass
230.130679816
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₈O₂
0 references
canonical SMILES
O=C1OC2=CC3=CCCC(C)C3(C)CC2=C1C
0 references
isomeric SMILES
CC1=C2C[C@@]3(C)C(=CCC[C@@H]3C)C=C2OC1=O
0 references
found in taxon
Ligularia
1 reference
stated in
Structure of a Guaioxide-type Sesquiterpene from “San-shion”
Packera aurea
1 reference
stated in
Tetrahydroligularenolide and related eremophilanes from Senecio aureus
Identifiers
InChI
InChI=1S/C15H18O2/c1-9-5-4-6-11-7-13-12(8-15(9,11)3)10(2)14(16)17-13/h6-7,9H,4-5,8H2,1-3H3/t9-,15+/m0/s1
0 references
InChIKey
ZRQPXMOBGPJKMQ-BJOHPYRUSA-N
0 references
PubChem CID
10059741
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
33585086
1 reference
stated in
UniChem
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