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(Q105144504)
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English
6-(3-hydroxybutyl)-7-methyl-3-methylidene-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one
group of stereoisomers with the chemical formula C₁₅H₂₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
xanthane sesquiterpenoid
1 reference
inferred from
xanthane sesquiterpenoid
mass
250.3339
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C1OC2CC(C(=CCC2C1=C)CCC(O)C)C
0 references
found in taxon
Carpesium cernuum
1 reference
stated in
Diversity of Sesquiterpenoids fromCarpesium cernuum
Xanthium macrocarpum
1 reference
stated in
Antileishmanial and antifungal activities of xanthanolides isolated from Xanthium macrocarpum.
Inula japonica
1 reference
stated in
Sesquiterpenes and other constituents from the aerial parts of Inula japonica
Xanthium orientale
1 reference
stated in
Antileishmanial and antifungal activities of xanthanolides isolated from Xanthium macrocarpum.
Identifiers
InChI
InChI=1S/C15H22O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9-10,13-14,16H,3-5,7-8H2,1-2H3
0 references
InChIKey
KQEADOUDJYBGFC-UHFFFAOYSA-N
0 references
PubChem CID
23928111
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
181864
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H22O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9-10,13-14,16H,3-5,7-8H2,1-2H3
UniChem compound ID
23202615
1 reference
stated in
UniChem
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