Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:28774 - 3,3',5'-triiodothyronine
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
3,3',5'-triiodothyronine
ChEBI ID
CHEBI:28774
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:1365, CHEBI:19863
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C15H12I3NO4
Net Charge
0
Average Mass
650.97353
Monoisotopic Mass
650.79004
InChI
InChI=1S/C15H12I3NO4/c16-
9-
3-
7(4-
12(19)
15(21)
22)
1-
2-
13(9)
23-
8-
5-
10(17)
14(20)
11(18)
6-
8/h1-
3,5-
6,12,20H,4,19H2,(H,21,22)
InChIKey
HZCBWYNLGPIQRK-UHFFFAOYSA-N
SMILES
NC(Cc1ccc(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
DOI
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3,3',5'-triiodothyronine (
CHEBI:28774
)
has role
human metabolite (
CHEBI:77746
)
3,3',5'-triiodothyronine (
CHEBI:28774
)
is a
iodothyronine (
CHEBI:24864
)
Incoming
3,3',5'-triiodo-
L
-thyronine (
CHEBI:11684
)
is a
3,3',5'-triiodothyronine (
CHEBI:28774
)
IUPAC Name
3,3',5'-triiodothyronine
Synonyms
Sources
3,3',5'-Triiodothyronine
KEGG COMPOUND
4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenylalanine
IUPAC
O
-(4-hydroxy-3,5-diiodophenyl)-3-iodotyrosine
IUPAC
Reverse triiodothyronine
ChemIDplus
Triiodothyronine, reverse
KEGG COMPOUND
Manual Xref
Database
C07639
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
2823534
Beilstein Registry Number
Beilstein
5817-39-0
CAS Registry Number
KEGG COMPOUND
5817-39-0
CAS Registry Number
ChemIDplus
Last Modified
10 March 2014