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(Q105132615)
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English
(6aS,7R,8S,10aS)-7,8-dimethyl-7-[2-(5-oxo-2H-furan-3-yl)ethyl]-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Desoxyarticulin
1 reference
based on heuristic
inferred from SMILES
4-(2-{7,8-dimethyl-3-oxo-1H,5H,6H,6aH,8H,9H,10H-naphtho[4,4a-c]furan-7-yl}ethyl)-5H-furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
330.183109312
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(6aR,7S,8R,10aS)-7,8-dimethyl-7-[2-(5-oxo-2H-furan-3-yl)ethyl]-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
6-Desoxysolidagolacton-IV-18,19-olid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₆O₄
0 references
canonical SMILES
O=C1OCC(=C1)CCC2(C)C(C)CCC34C(=CCCC32)C(=O)OC4
0 references
isomeric SMILES
C[C@H]1CC[C@@]23COC(=O)C2=CCC[C@H]3[C@]1(C)CCC1=CC(=O)OC1
0 references
found in taxon
Gutierrezia texana
1 reference
stated in
Ten cis-clerodane-type diterpene lactones from Gutierrezia texana
Identifiers
InChI
InChI=1S/C20H26O4/c1-13-6-9-20-12-24-18(22)15(20)4-3-5-16(20)19(13,2)8-7-14-10-17(21)23-11-14/h4,10,13,16H,3,5-9,11-12H2,1-2H3/t13-,16-,19+,20+/m0/s1
0 references
InChIKey
JPADNOYXVVHBCB-DYLQCGAMSA-N
0 references
PubChem CID
13857181
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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