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Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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CHEBI:82269 - TCA-ethadyl
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ChEBI Ontology
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ChEBI Name
TCA-ethadyl
ChEBI ID
CHEBI:82269
Stars
This entity has been manually annotated by a third party.
Supplier Information
eMolecules:35875798
,
ZINC000001602464
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Formula
C6H4Cl6O4
Net Charge
0
Average Mass
352.81200
Monoisotopic Mass
349.82407
InChI
InChI=1S/C6H4Cl6O4/c7-5(8,9)3(13)15-1-2-16-4(14)6(10,11)12/h1-2H2
InChIKey
SSDZRWBPFCFZGB-UHFFFAOYSA-N
SMILES
ClC(Cl)(Cl)C(=O)OCCOC(=O)C(Cl)(Cl)Cl
ChEBI Ontology
Outgoing
TCA-ethadyl (
CHEBI:82269
)
has functional parent
ethylene glycol (
CHEBI:30742
)
TCA-ethadyl (
CHEBI:82269
)
has functional parent
trichloroacetic acid (
CHEBI:30956
)
TCA-ethadyl (
CHEBI:82269
)
is a
diester (
CHEBI:51307
)
Manual Xref
Database
C19149
KEGG COMPOUND
View more database links
Registry Number
Type
Source
2514-53-6
CAS Registry Number
KEGG COMPOUND
Last Modified
12 May 2016