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:125678 -
N
-acetyldopamine
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
N
-acetyldopamine
ChEBI ID
CHEBI:125678
ChEBI ASCII Name
N-acetyldopamine
Definition
A secondary carboxamide obtained by formal condensation of the carboxy group of acetic acid with the amino group of dopamine. A dopamine metabolite.
Stars
This entity has been manually annotated by the ChEBI Team.
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
C10H13NO3
Net Charge
0
Average Mass
195.216
Monoisotopic Mass
195.08954
InChI
InChI=1S/C10H13NO3/c1-7(12)11-5-4-8-2-3-9(13)10(14)6-8/h2-3,6,13-14H,4-5H2,1H3,(H,11,12)
InChIKey
OFSAJYZMIPNPHE-UHFFFAOYSA-N
SMILES
CC(=O)NCCC1=CC(=C(C=C1)O)O
Metabolite of Species
Details
Tribolium castaneum
(NCBI:txid7070)
See:
PubMed
Aedes aegypti
(NCBI:txid7159)
See:
PubMed
Apis mellifera
(NCBI:txid7460)
See:
PubMed
Carassius auratus
(NCBI:txid7957)
Found in liver
(BTO:0000759)
. See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Roles Classification
Biological Role
(s):
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
N
-acetyldopamine (
CHEBI:125678
)
has functional parent
dopamine (
CHEBI:18243
)
N
-acetyldopamine (
CHEBI:125678
)
has role
human urinary metabolite (
CHEBI:84087
)
N
-acetyldopamine (
CHEBI:125678
)
has role
marine metabolite (
CHEBI:76507
)
N
-acetyldopamine (
CHEBI:125678
)
is a
N
-(fatty acyl)-dopamine (
CHEBI:157740
)
N
-acetyldopamine (
CHEBI:125678
)
is a
acetamides (
CHEBI:22160
)
N
-acetyldopamine (
CHEBI:125678
)
is a
catechols (
CHEBI:33566
)
N
-acetyldopamine (
CHEBI:125678
)
is a
secondary carboxamide (
CHEBI:140325
)
IUPAC Name
N
-[2-(3,4-dihydroxyphenyl)ethyl]acetamide
Synonyms
Sources
N
-acetyl-dopamine
UniProt
NADA
ChEBI
NSC 314644
ChemIDplus
Manual Xrefs
Databases
C00033243
KNApSAcK
HMDB0041943
HMDB
KR20070000663
Patent
KR20070109261
Patent
LSM-37245
LINCS
View more database links
Registry Numbers
Types
Sources
2494-12-4
CAS Registry Number
ChemIDplus
2806306
Beilstein Registry Number
ChemIDplus
2806306
Reaxys Registry Number
Reaxys
Citations
Types
Sources
1447347
PubMed citation
Europe PMC
16179544
PubMed citation
Europe PMC
16179545
PubMed citation
Europe PMC
20428047
PubMed citation
Europe PMC
20446293
PubMed citation
Europe PMC
21645618
PubMed citation
Europe PMC
22537672
PubMed citation
Europe PMC
22784829
PubMed citation
Europe PMC
23466408
PubMed citation
Europe PMC
23510859
PubMed citation
Europe PMC
27816487
PubMed citation
Europe PMC
28557057
PubMed citation
Europe PMC
6513727
PubMed citation
Europe PMC
7918576
PubMed citation
Europe PMC
9266600
PubMed citation
Europe PMC
IND21635639
Agricola citation
Europe PMC
Last Modified
10 April 2018