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(Q105240070)
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English
Rlhpcssgtqnsjn-fomnrloisa-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Costunolide derivative
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R,3aS,6E,9S,10Z,11aS)-9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3S,3aR,6E,9R,10E,11aS)-9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R,3aS,6E,9S,10E,11aS)-9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from InChI
(3S,3aS,6E,9R,10E,11aS)-9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from InChI
Artabin
1 reference
based on heuristic
inferred from InChI
(3S,3aS,6E,9S,10Z,11aS)-9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from InChI
(3R,3aS,6Z,9S,10E,11aR)-9-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C1OC2C=C(C)C(O)CC=C(C)CCC2C1C
0 references
isomeric SMILES
C/C1=C\C[C@H](O)/C(C)=C/[C@H]2OC(=O)[C@@H](C)[C@@H]2CC1
0 references
found in taxon
Artemisia arborescens
1 reference
stated in
Sesquiterpene lactones and lignans from Artemisia arborescens
Identifiers
InChI
InChI=1S/C15H22O3/c1-9-4-6-12-11(3)15(17)18-14(12)8-10(2)13(16)7-5-9/h5,8,11-14,16H,4,6-7H2,1-3H3/b9-5+,10-8+/t11-,12-,13-,14+/m0/s1
0 references
InChIKey
RLHPCSSGTQNSJN-FOMNRLOISA-N
0 references
PubChem CID
23259348
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RLHPCSSGTQNSJN-FOMNRLOISA-N
UniChem compound ID
8106927
1 reference
stated in
UniChem
NMRShiftDB structure ID
20173816
1 reference
matched by identifier from
InChIKey
InChIKey
RLHPCSSGTQNSJN-FOMNRLOISA-N
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