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(Q104952711)
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English
(1R,3S,6R,7R,10S,11R)-3,7,12-trimethyl-2,9-dioxatetracyclo[9.3.0.01,3.06,10]tetradec-12-en-8-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1,4a,7-Trimethyl-5,6,6a,7,9a,9b-hexahydro-3H-oxireno[2',3':8,8a]azuleno[4,5-b]furan-8(4ah)-one
1 reference
based on heuristic
inferred from SMILES
mass
248.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,3R,6S,7S,10S,11S)-3,7,12-trimethyl-2,9-dioxatetracyclo[9.3.0.01,3.06,10]tetradec-12-en-8-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,3R,6S,7R,10S,11R)-3,7,12-trimethyl-2,9-dioxatetracyclo[9.3.0.01,3.06,10]tetradec-12-en-8-one
1 reference
based on heuristic
inferred from InChI
arborescin
1 reference
based on heuristic
inferred from InChI
(1S,3R,6S,7S,10S,11R)-3,7,12-trimethyl-2,9-dioxatetracyclo[9.3.0.01,3.06,10]tetradec-12-en-8-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₃
0 references
canonical SMILES
O=C1OC2C3C(=CCC43OC4(C)CCC2C1C)C
0 references
isomeric SMILES
CC1=CC[C@]23O[C@@]2(C)CC[C@H]2[C@H](OC(=O)[C@@H]2C)[C@@H]13
0 references
found in taxon
Artemisia nitrosa
1 reference
stated in
Seco-guaianolides and other constituents from Artemisia species
Artemisia mongolorum
1 reference
stated in
Seco-guaianolides and other constituents from Artemisia species
Seriphidium mongolorum
1 reference
stated in
Seco-guaianolides and other constituents from Artemisia species
Identifiers
InChI
InChI=1S/C15H20O3/c1-8-4-7-15-11(8)12-10(9(2)13(16)17-12)5-6-14(15,3)18-15/h4,9-12H,5-7H2,1-3H3/t9-,10-,11-,12+,14+,15-/m1/s1
0 references
InChIKey
CBRKCJOSZHRKFH-PWDJSDCWSA-N
0 references
PubChem CID
162923765
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CBRKCJOSZHRKFH-PWDJSDCWSA-N
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