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(Q104246470)
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English
(5E,10E)-10-benzyl-11-chloro-5,7-dimethylundeca-1,5,10-trien-4-ol
group of stereoisomers with the chemical formula C₂₀H₂₇ClO
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
318.175043164
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₇ClO
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canonical SMILES
ClC=C(CC=1C=CC=CC1)CCC(C=C(C)C(O)CC=C)C
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isomeric SMILES
C=CCC(O)/C(C)=C/C(C)CC/C(=C\Cl)Cc1ccccc1
1 reference
based on heuristic
inferred from InChI
found in taxon
Trichodesmium thiebautii
1 reference
stated in
Structure revision of trichotoxin, a chlorinated polyketide isolated from a Trichodesmium thiebautii bloom
Oscillatoria thiebautii
1 reference
stated in
Structure revision of trichotoxin, a chlorinated polyketide isolated from a Trichodesmium thiebautii bloom
Identifiers
InChI
InChI=1S/C20H27ClO/c1-4-8-20(22)17(3)13-16(2)11-12-19(15-21)14-18-9-6-5-7-10-18/h4-7,9-10,13,15-16,20,22H,1,8,11-12,14H2,2-3H3/b17-13+,19-15+
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InChIKey
ANQYSAMBWZMXEL-CAKLOUMDSA-N
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