The Prescription of Drugs Ontology

Last uploaded: September 4, 2020

Preferred Name	D-thyroxine
Synonyms	D-thyroxine dextrothyroxine O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-D-tyrosine D-T4 DT4
Definitions	The D-enantiomer of thyroxine.
ID	http://purl.obolibrary.org/obo/CHEBI_30659
charge	0
database_cross_reference	DrugBank:DB00509 Beilstein:2954910 CAS:51-49-0 PMID:15206581 PMID:21035598 PMID:20020587 PMID:2062236 Wikipedia:Dextrothyroxine Drug_Central:846 PMID:20483419
formula	C15H11I4NO4
has_exact_synonym	D-thyroxine
has_obo_namespace	chebi_ontology
has_related_synonym	dextrothyroxine O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-D-tyrosine D-T4 DT4
id	CHEBI:30659
in_subset	http://purl.obolibrary.org/obo/chebi#3_STAR
inchi	InChI=1S/C15H11I4NO4/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)/t12-/m1/s1
inchikey	XUIIKFGFIJCVMT-GFCCVEGCSA-N
is enantiomer of	http://purl.obolibrary.org/obo/CHEBI_18332
label	D-thyroxine
mass	776.87006
monoisotopicmass	776.68669
notation	CHEBI:30659
prefLabel	D-thyroxine
smiles	N[C@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O
textual definition	The D-enantiomer of thyroxine.
subClassOf	http://purl.obolibrary.org/obo/CHEBI_30660 http://purl.obolibrary.org/obo/CHEBI_84124

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_30659	OBA	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_30659	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_30659	GO-PLUS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_30659	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_30659	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_30659	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_30659	OBA	LOOM
http://purl.obolibrary.org/obo/CHEBI_30659	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_30659	GO-PLUS	LOOM
http://purl.obolibrary.org/obo/CHEBI_30659	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_30659	BIOMODELS	LOOM