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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:30660 - thyroxine
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ChEBI Name
thyroxine
ChEBI ID
CHEBI:30660
Definition
An iodothyronine compound having iodo substituents at the 3-, 3'-, 5- and 5'-positions.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C15H11I4NO4
Net Charge
0
Average Mass
776.87006
Monoisotopic Mass
776.68669
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)
InChIKey
XUIIKFGFIJCVMT-UHFFFAOYSA-N
SMILES
NC(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O
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):
mitogen
A chemical substance that encourages a cell to commence cell division, triggering mitosis.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
thyroxine (
CHEBI:30660
)
has role
mitogen (
CHEBI:52290
)
thyroxine (
CHEBI:30660
)
is a
2-halophenol (
CHEBI:53291
)
thyroxine (
CHEBI:30660
)
is a
iodophenol (
CHEBI:24863
)
thyroxine (
CHEBI:30660
)
is a
iodothyronine (
CHEBI:24864
)
thyroxine (
CHEBI:30660
)
is a
non-proteinogenic α-amino acid (
CHEBI:83925
)
thyroxine (
CHEBI:30660
)
is a
tyrosine derivative (
CHEBI:62761
)
thyroxine (
CHEBI:30660
)
is tautomer of
thyroxine zwitterion (
CHEBI:305790
)
Incoming
thyroxine sulfate (
CHEBI:53508
)
has functional parent
thyroxine (
CHEBI:30660
)
D
-thyroxine (
CHEBI:30659
)
is a
thyroxine (
CHEBI:30660
)
L
-thyroxine (
CHEBI:18332
)
is a
thyroxine (
CHEBI:30660
)
thyroxine zwitterion (
CHEBI:305790
)
is tautomer of
thyroxine (
CHEBI:30660
)
IUPAC Name
thyroxine
Synonyms
Sources
2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid
IUPAC
DL-Thyroxine
ChemIDplus
O-(4-Hydroxy-3,5-diiodophenyl)-3,5-diiodo-DL-tyrosine
ChemIDplus
Thx
IUPAC
Registry Numbers
Types
Sources
2228514
Beilstein Registry Number
Beilstein
300-30-1
CAS Registry Number
ChemIDplus
Citations
Types
Sources
15206581
PubMed citation
Europe PMC
24375501
PubMed citation
Europe PMC
9824273
PubMed citation
Europe PMC
Last Modified
17 December 2014