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(Q104944479)
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English
(3aR)-4aalpha-(Hydroperoxy)-8beta-hydroxy-3beta,5-dimethylene-8abeta-methyl-3aalpha,4,4a,5,6,7,8,8a,9,9aalpha-decahydronaphtho[2,3-b]furan-2(3H)-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4a-hydroperoxy-8-hydroxy-8a-methyl-3,5-dimethylidene-hexahydro-3aH-naphtho[2,3-b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
280.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₀O₅
0 references
canonical SMILES
O=C1OC2CC3(C)C(O)CCC(=C)C3(OO)CC2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@H](O)CCC(=C)[C@]3(OO)C[C@H]12
0 references
found in taxon
Eriocephalus africanus
1 reference
stated in
Sesquiterpene lactones and other constituents from Eriocephalus species
Inula japonica
1 reference
stated in
Sesquiterpenoids from the Aerial Parts of Inula japonica
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/C15H20O5/c1-8-4-5-12(16)14(3)7-11-10(6-15(8,14)20-18)9(2)13(17)19-11/h10-12,16,18H,1-2,4-7H2,3H3/t10-,11-,12-,14+,15-/m1/s1
0 references
InChIKey
BQOHWXIYPOOARZ-MYYUVRNCSA-N
0 references
PubChem CID
13895697
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
BQOHWXIYPOOARZ-MYYUVRNCSA-N
UniChem compound ID
101168793
1 reference
stated in
UniChem
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