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(Q104994272)
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English
3beta,5beta,8abeta-Trimethyl-8beta-hydroxy-3aalpha,5,6,7,8,8a,9,9aalpha-octahydronaphtho[2,3-b]furan-2(3H)-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
eudesmane sesquiterpenoid
0 references
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
3beta,5beta,8abeta-Trimethyl-8alpha-hydroxy-3aalpha,5,6,7,8,8a,9,9aalpha-octahydronaphtho[2,3-b]furan-2(3H)-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C1OC2CC3(C(=CC2C1C)C(C)CCC3O)C
0 references
isomeric SMILES
C[C@H]1CC[C@@H](O)[C@]2(C)C[C@H]3OC(=O)[C@@H](C)[C@H]3C=C12
0 references
found in taxon
Inula japonica
1 reference
stated in
Sesquiterpenoids from the Aerial Parts of Inula japonica
Inula thapsoides
1 reference
stated in
Eudesmanolides and other constituents of Inula thapsoides
Inula britannica
1 reference
stated in
Sesquiterpenoids from the Aerial Parts of Inula japonica
Pentanema britannicum
1 reference
stated in
Sesquiterpenoids from the Aerial Parts of Inula japonica
Identifiers
InChI
InChI=1S/C15H22O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h6,8-10,12-13,16H,4-5,7H2,1-3H3/t8-,9-,10+,12+,13+,15+/m0/s1
0 references
InChIKey
FEYQLIJGWGWQNT-OVIZQLOJSA-N
0 references
PubChem CID
101936593
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FEYQLIJGWGWQNT-OVIZQLOJSA-N
UniChem compound ID
97535298
1 reference
stated in
UniChem
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