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(Q105300558)
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English
(5R,5aS,8aS,9R,9aS)-9-hydroxy-5,7,7-trimethyl-1,5,5a,6,8,8a,9,9a-octahydroazuleno[5,6-c]furan-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Blennin A
1 reference
based on heuristic
inferred from SMILES
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
3abeta,4,4abeta,5,6,7,7abeta,8-Octahydro-4beta-hydroxy-6,6,8beta-trimethylazuleno[5,6-c]furan-1(3H)-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aalpha,4beta,4abeta,7abeta,8beta)-3a,4,4a,5,6,7,7a,8-Octahydro-4-hydroxy-6,6,8-trimethylazuleno[5,6-c]furan-1(3H)-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C1OCC2C1=CC(C)C3CC(C)(C)CC3C2O
0 references
isomeric SMILES
C[C@H]1C=C2C(=O)OC[C@H]2[C@H](O)[C@H]2CC(C)(C)C[C@H]21
0 references
found in taxon
Lactarius blennius
1 reference
stated in
Sesquiterpenes from Lactarius blennius
Identifiers
InChI
InChI=1S/C15H22O3/c1-8-4-9-12(7-18-14(9)17)13(16)11-6-15(2,3)5-10(8)11/h4,8,10-13,16H,5-7H2,1-3H3/t8-,10-,11-,12+,13+/m0/s1
0 references
InChIKey
WAZRIBIDVKNFFE-KHAFSYESSA-N
0 references
PubChem CID
162953305
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WAZRIBIDVKNFFE-KHAFSYESSA-N
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