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(Q105306616)
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English
[(3aS,5aS,7R,8aS,9aR)-8a-hydroxy-1,5,8-trimethylidene-2-oxo-4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-7-yl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4a-hydroxy-3,5,8-trimethylidene-2-oxo-hexahydro-3aH-azuleno[6,5-b]furan-6-yl acetate
1 reference
based on heuristic
inferred from SMILES
mass
304.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(3aS,5aS,7S,8aS,9aR)-8a-hydroxy-1,5,8-trimethylidene-2-oxo-4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-7-yl] acetate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₀O₅
0 references
canonical SMILES
O=C1OC2CC(=C)C3CC(OC(=O)C)C(=C)C3(O)CC2C1=C
0 references
isomeric SMILES
C=C1C[C@@H]2OC(=O)C(=C)[C@H]2C[C@@]2(O)C(=C)[C@H](OC(C)=O)C[C@@H]12
0 references
found in taxon
Arctotis fastuosa
1 reference
stated in
Guaianolides from Venidium fastuosum
Arctotis stoechadifolia
1 reference
stated in
Isolation and structures of sesquiterpene lactones: Aerial parts of Arctotis grandis THUNB. species
Arctotis hirsuta
1 reference
stated in
Sesquiterpene lactones from Venidium hirsutum BEROL. species
Identifiers
InChI
InChI=1S/C17H20O5/c1-8-5-15-12(9(2)16(19)22-15)7-17(20)10(3)14(6-13(8)17)21-11(4)18/h12-15,20H,1-3,5-7H2,4H3/t12-,13+,14-,15+,17-/m1/s1
0 references
InChIKey
WIZNAGDVYMRDHS-LBKYZSNHSA-N
0 references
PubChem CID
14285653
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WIZNAGDVYMRDHS-LBKYZSNHSA-N
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