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> Main
CHEBI:70772 - 4-hydroxytryptophan
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ChEBI Ontology
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ChEBI Name
4-hydroxytryptophan
ChEBI ID
CHEBI:70772
Definition
A hydroxytryptophan substituted by a hydroxy group at position 4 on the indole ring.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C11H12N2O3
Net Charge
0
Average Mass
220.22460
Monoisotopic Mass
220.08479
InChI
InChI=1S/C11H12N2O3/c12-7(11(15)16)4-6-5-13-8-2-1-3-9(14)10(6)8/h1-3,5,7,13-14H,4,12H2,(H,15,16)
InChIKey
QSHLMQDRPXXYEE-UHFFFAOYSA-N
SMILES
NC(Cc1c[nH]c2cccc(O)c12)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):
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
4-hydroxytryptophan (
CHEBI:70772
)
has role
human urinary metabolite (
CHEBI:84087
)
4-hydroxytryptophan (
CHEBI:70772
)
is a
hydroxytryptophan (
CHEBI:84194
)
Incoming
4-hydroxy-
L
-tryptophan (
CHEBI:40072
)
is a
4-hydroxytryptophan (
CHEBI:70772
)
IUPAC Names
2-amino-3-(4-hydroxy-1
H
-indol-3-yl)propanoic acid
4-hydroxytryptophan
Synonym
Source
4-hydroxy-
D
L
-tryptophan
ChemIDplus
Manual Xref
Database
LSM-36828
LINCS
View more database links
Registry Numbers
Types
Sources
16533-77-0
CAS Registry Number
ChemIDplus
482548
Reaxys Registry Number
Reaxys
Citation
Type
Source
22770225
PubMed citation
Europe PMC
Last Modified
26 February 2016