EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:6447 - levothyroxine sodium hydrate

Default Structure
ChEBI IDCHEBI:6447
ChEBI Namelevothyroxine sodium hydrate
Stars
Last Modified4 November 2008
DownloadsMolfile
FormulaC15H10I4NO4.H2O.Na
Net Charge0
Average Mass816.869
Monoisotopic Mass816.67921
SMILESN[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)[O-].O.[Na+]
InChIInChI=1S/C15H11I4NO4.Na.H2O/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23;;/h1-2,4-5,12,21H,3,20H2,(H,22,23);;1H2/q;+1;/p-1/t12-;;/m0../s1
InChIKeyANMYAHDLKVNJJO-LTCKWSDVSA-M
ChEBI Ontology
Outgoing Relation(s)
levothyroxine sodium hydrate (CHEBI:6447) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
D01010KEGG DRUG
DB00451DrugBank
Registry NumbersSources
CAS:25416-65-3ChemIDplus