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CHEBI:145228 - triiodothyronine glucuronide

Default Structure
ChEBI IDCHEBI:145228
ChEBI Nametriiodothyronine glucuronide
Stars
Submittermwilliams
DownloadsMolfile
FormulaC21H20I3NO10
Net Charge0
Average Mass827.100
Monoisotopic Mass826.82214
SMILESN[C@@H](Cc1cc(I)c(Oc2ccc(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c(I)c2)c(I)c1)C(=O)O
InChIInChI=1S/C21H20I3NO10/c22-9-6-8(33-17-10(23)3-7(4-11(17)24)5-12(25)19(29)30)1-2-13(9)34-21-16(28)14(26)15(27)18(35-21)20(31)32/h1-4,6,12,14-16,18,21,26-28H,5,25H2,(H,29,30)(H,31,32)/t12-,14-,15-,16+,18-,21+/m0/s1
InChIKeyYYFGGGCINNGOLE-ZDXOGFQLSA-N
ChEBI Ontology
Outgoing Relation(s)
triiodothyronine glucuronide (CHEBI:145228) is a phenylalanine derivative (CHEBI:25985)
Manual XrefsDatabases
HMDB0010346HMDB