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(Q105185294)
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English
(3S)-3beta,6alpha,9aalpha-Trimethyl-9alpha-hydroxy-2,3,3abeta,4,5,6,8,9,9a,9bbeta-decahydroazuleno[4,5-b]furan-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pseudoguaiane sesquiterpenoid
1 reference
based on heuristic
inferred from SMILES
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C1OC2C(CCC(C3=CCC(O)C32C)C)C1C
0 references
isomeric SMILES
C[C@H]1CC[C@H]2[C@H](C)C(=O)O[C@H]2[C@@]2(C)C1=CC[C@@H]2O
0 references
found in taxon
Parthenium hysterophorus
1 reference
stated in
Two New Pseudoguaianolides from the Flowers ofParthenium hysterophorus
Identifiers
InChI
InChI=1S/C15H22O3/c1-8-4-5-10-9(2)14(17)18-13(10)15(3)11(8)6-7-12(15)16/h6,8-10,12-13,16H,4-5,7H2,1-3H3/t8-,9-,10-,12-,13+,15-/m0/s1
0 references
InChIKey
NSXOJVHAIMBONL-BOEATCMXSA-N
0 references
PubChem CID
102407899
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NSXOJVHAIMBONL-BOEATCMXSA-N
UniChem compound ID
96627292
1 reference
stated in
UniChem
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