Preferred Name

4-(trimethylammonio)butanoate

Synonyms

4-(trimethylammonio)butanoate

4-(N-trimethylamino)butyrate

deoxycarnitine

4-(trimethylamino)butanoate

3-Dehydroxycarnitine

4-butyrobetaine

gamma-Butyrobetain

butyrobetaine

Actinine

gamma-butyrobetaine

Definitions

An amino-acid betaine gamma-aminobutyric acid zwitterion in which all of the hydrogens attached to the nitrogen are replaced by methyl groups.

ID

http://purl.obolibrary.org/obo/CHEBI_16244

charge

0

database_cross_reference

Beilstein:3538300

ECMDB:ECMDB21336

PMID:3148329

Reaxys:3538300

PMID:398096

CAS:407-64-7

HMDB:HMDB0006831

MetaCyc:GAMMA-BUTYROBETAINE

definition

An amino-acid betaine gamma-aminobutyric acid zwitterion in which all of the hydrogens attached to the nitrogen are replaced by methyl groups.

formula

C7H15NO2

has functional parent

http://purl.obolibrary.org/obo/CHEBI_59888

http://purl.obolibrary.org/obo/CHEBI_30566

has role

http://purl.obolibrary.org/obo/CHEBI_77746

http://purl.obolibrary.org/obo/CHEBI_76971

has_alternative_id

CHEBI:12047

CHEBI:20484

has_exact_synonym

4-(trimethylammonio)butanoate

has_obo_namespace

chebi_ontology

has_related_synonym

4-(N-trimethylamino)butyrate

deoxycarnitine

4-(trimethylamino)butanoate

3-Dehydroxycarnitine

4-butyrobetaine

gamma-Butyrobetain

butyrobetaine

Actinine

gamma-butyrobetaine

id

CHEBI:16244

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C7H15NO2/c1-8(2,3)6-4-5-7(9)10/h4-6H2,1-3H3

inchikey

JHPNVNIEXXLNTR-UHFFFAOYSA-N

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_1941

label

4-(trimethylammonio)butanoate

mass

145.19954

monoisotopicmass

145.11028

notation

CHEBI:16244

prefLabel

4-(trimethylammonio)butanoate

smiles

C[N+](C)(C)CCCC([O-])=O

treeView

http://purl.obolibrary.org/obo/CHEBI_22860

subClassOf

http://purl.obolibrary.org/obo/CHEBI_22860

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