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(Q104201472)
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English
3-Furan-3-yl-3a,7-dimethyl-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one
group of stereoisomers with the chemical formula C₁₄H₁₆O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
232.109944372
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₆O₃
0 references
canonical SMILES
O=C1OC(C2=COC=C2)C3(C1=C(C)CCC3)C
0 references
found in taxon
Melia
1 reference
stated in
Degraded limonoids from Melia azedarach and biogenetic implications
Dictamnus albus
3 references
stated in
Limonoids from the root of Dictamnus radicis cortex
stated in
Neuroprotective limonoids of root bark of Dictamnus dasycarpus
stated in
Note on the presence of aurapten in Dictamnus albus
Identifiers
InChI
InChI=1S/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3
0 references
InChIKey
XYYAFLHHHZVPRN-UHFFFAOYSA-N
0 references
PubChem CID
500095
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
XYYAFLHHHZVPRN-UHFFFAOYSA-N
ChEBI ID
181329
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3
UniChem compound ID
813107
1 reference
stated in
UniChem
Probes And Drugs ID
PD086885
0 references
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