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(Q105015114)
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English
(3aR)-4aalpha,8beta-Dihydroxy-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,8-dihydroxy-8a-methyl-3,5-dimethylidene-hexahydro-3aH-naphtho[2,3-b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
264.13615912
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aR,4aS,8R,8aS,9aR)-4a,8-dihydroxy-8a-methyl-3,5-dimethylidene-4,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₄
0 references
canonical SMILES
O=C1OC2CC3(C)C(O)CCC(=C)C3(O)CC2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@H](O)CCC(=C)[C@]3(O)C[C@H]12
0 references
found in taxon
Inula japonica
1 reference
stated in
New sesquiterpenes from Inula japonica Thunb. with their inhibitory activities against LPS-induced NO production in RAW264.7 macrophages
Inula britannica
1 reference
stated in
New sesquiterpenes from Inula japonica Thunb. with their inhibitory activities against LPS-induced NO production in RAW264.7 macrophages
Pentanema britannicum
1 reference
stated in
New sesquiterpenes from Inula japonica Thunb. with their inhibitory activities against LPS-induced NO production in RAW264.7 macrophages
Identifiers
InChI
InChI=1S/C15H20O4/c1-8-4-5-12(16)14(3)7-11-10(6-15(8,14)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
GPTBAALURMUXBS-MYYUVRNCSA-N
0 references
PubChem CID
13895699
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GPTBAALURMUXBS-MYYUVRNCSA-N
UniChem compound ID
101168794
1 reference
stated in
UniChem
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