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(Q105131900)
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Emmotin F
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
emmotin sesquiterpenoid
0 references
mass
248.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₀O₃
0 references
canonical SMILES
O=C1C=2C(=CC=C(C2CC(C1O)C(O)(C)C)C)C
0 references
isomeric SMILES
Cc1ccc(C)c2c1C[C@H](C(C)(C)O)[C@@H](O)C2=O
0 references
found in taxon
Emmotum nitens
1 reference
stated in
Structure and absolute configuration of the sesquiterpenoid emmotins
Identifiers
InChI
InChI=1S/C15H20O3/c1-8-5-6-9(2)12-10(8)7-11(15(3,4)18)13(16)14(12)17/h5-6,11,13,16,18H,7H2,1-4H3/t11-,13+/m0/s1
0 references
InChIKey
JNGKSECPHZPRSM-WCQYABFASA-N
0 references
PubChem CID
101316763
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
97289588
1 reference
stated in
UniChem
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