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:137728 - tetragastrin
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
tetragastrin
ChEBI ID
CHEBI:137728
Definition
A tetrapeptide composed of
L
-tryptophan,
L
-methione,
L
-aspartic acid and
L
-phenylalaninamide residues joined in sequence.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:32210
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Wikipedia
License
Read full article at Wikipedia
Formula
C29H36N6O6S
Net Charge
0
Average Mass
596.700
Monoisotopic Mass
596.24170
InChI
InChI=1S/C29H36N6O6S/c1-
42-
12-
11-
22(33-
27(39)
20(30)
14-
18-
16-
32-
21-
10-
6-
5-
9-
19(18)
21)
28(40)
35-
24(15-
25(36)
37)
29(41)
34-
23(26(31)
38)
13-
17-
7-
3-
2-
4-
8-
17/h2-
10,16,20,22-
24,32H,11-
15,30H2,1H3,(H2,31,38)
(H,33,39)
(H,34,41)
(H,35,40)
(H,36,37)
/t20-
,22-
,23-
,24-
/m0/s1
InChIKey
RGYLYUZOGHTBRF-BIHRQFPBSA-N
SMILES
C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC=3C=CC=CC3)C(N)=O)CC(O)=O)CCSC
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
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
)
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
Application
(s):
anxiogenic
Any psychotropic drug that induces anxiety or panic.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
tetragastrin (
CHEBI:137728
)
has role
anxiogenic (
CHEBI:137736
)
tetragastrin (
CHEBI:137728
)
has role
human metabolite (
CHEBI:77746
)
tetragastrin (
CHEBI:137728
)
is a
peptidyl amide (
CHEBI:15722
)
tetragastrin (
CHEBI:137728
)
is a
tetrapeptide (
CHEBI:48030
)
IUPAC Name
L
-
tryptophyl-
L
-
methionyl-
L
-
α-
aspartyl-
L
-
phenylalaninamide
Synonyms
Sources
CCK-4
ChEBI
CCRIS 3246
ChemIDplus
Cholecystokinin tetrapeptide
ChemIDplus
cholecystokinin-4
ChEBI
Gastrin tetrapeptide
ChemIDplus
Gastrin tetrapeptide amide
ChemIDplus
L
-
Trp-
L
-
Met-
L
-
Asp-
L
-
Phe-
NH
2
ChEBI
L
-
tryptophyl-
L
-
methionyl-
L
-
aspartyl-
L
-
phenylalaninamide
ChEBI
Trp-Met-Asp-Phe-NH
2
ChEBI
WMDF-NH
2
ChEBI
Manual Xrefs
Databases
CCK-4
Wikipedia
D01456
KEGG DRUG
HMDB0005775
HMDB
View more database links
Registry Numbers
Types
Sources
1947-37-1
CAS Registry Number
ChemIDplus
24193542
Reaxys Registry Number
Reaxys
4223651
Reaxys Registry Number
Reaxys
Citations
Types
Sources
20198494
PubMed citation
Europe PMC
20387390
PubMed citation
Europe PMC
22414867
PubMed citation
Europe PMC
22632477
PubMed citation
Europe PMC
22939006
PubMed citation
Europe PMC
23059050
PubMed citation
Europe PMC
23463151
PubMed citation
Europe PMC
24342768
PubMed citation
Europe PMC
24939759
PubMed citation
Europe PMC
25106129
PubMed citation
Europe PMC
25522396
PubMed citation
Europe PMC
26235955
PubMed citation
Europe PMC
26752621
PubMed citation
Europe PMC
27871026
PubMed citation
Europe PMC
28328228
PubMed citation
Europe PMC
Last Modified
10 August 2017