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(Q104397742)
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Balchanolide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-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
(3R,3aR,4R,6E,10E,11aS)-4-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,4R,6Z,10Z,11aS)-4-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,3aR,4R,6E,10E,11aR)-4-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,3aR,4S,11aR)-4-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,3aR,4S,6E,10E,11aR)-4-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,4S,6E,10E,11aR)-4-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,3aR,4S,6Z,10E,11aS)-4-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)CCC=C(C)CC(O)C2C1C
0 references
isomeric SMILES
C/C1=C/[C@H]2OC(=O)[C@@H](C)[C@@H]2[C@@H](O)C/C(C)=C\CC1
0 references
found in taxon
Artemisia barrelieri
1 reference
stated in
Sesquiterpene lactones fromArtemisia barrelieri
Achillea atrata
1 reference
stated in
Flavones and sesquiterpene lactones from Achillea atrata subsp. multifida: antimicrobial activity
Achillea collina
1 reference
stated in
Sesquiterpene lactones from Achillea collina Becker.
Achillea millefolium
1 reference
stated in
Sesquiterpene lactones from Achillea millefolium
Artemisia inculta
1 reference
stated in
Sesquiterpene lactones from Artemisia inculta
Tanacetopsis mucronata
1 reference
stated in
Mucronin ? A new germacranolide fromTanacetopsis mucronata
Artemisia herba-alba
1 reference
stated in
New Germacranolides and Eudesmanolides from North African Artemisia herba-alba
Identifiers
InChI
InChI=1S/C15H22O3/c1-9-5-4-6-10(2)8-13-14(12(16)7-9)11(3)15(17)18-13/h5,8,11-14,16H,4,6-7H2,1-3H3/b9-5-,10-8-/t11-,12-,13+,14+/m0/s1
0 references
InChIKey
TXSIFZZILWRCIY-XWXMLLEXSA-N
0 references
PubChem CID
101289676
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
97598173
1 reference
stated in
UniChem
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