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CHEBI:91242 - glycine betaine hydrate
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ChEBI Ontology
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ChEBI Name
glycine betaine hydrate
ChEBI ID
CHEBI:91242
Definition
A hydrate that is the monohydrate form of glycine betaine.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C5H13NO3
Net Charge
0
Average Mass
135.162
Monoisotopic Mass
135.08954
InChI
InChI=1S/C5H11NO2.H2O/c1-6(2,3)4-5(7)8;/h4H2,1-3H3;1H2
InChIKey
NJZRLXNBGZBREL-UHFFFAOYSA-N
SMILES
[N+](C)(C)(C)CC(=O)[O-].O
Roles Classification
Biological Role
(s):
fundamental metabolite
Any metabolite produced by all living cells.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
glycine betaine hydrate (
CHEBI:91242
)
has part
N
,
N
,
N
-trimethylglycinium (
CHEBI:41139
)
glycine betaine hydrate (
CHEBI:91242
)
has role
fundamental metabolite (
CHEBI:78675
)
glycine betaine hydrate (
CHEBI:91242
)
is a
hydrate (
CHEBI:35505
)
IUPAC Names
(trimethylazaniumyl)acetate—water (1/1)
carboxy-N,N,N-trimethylmethanaminium hydroxide
Synonyms
Sources
(Carboxymethyl)trimethylammonium hydroxide
ChemIDplus
(trimethylazaniumyl)acetate hydrate
ChEBI
Betaine monohydrate
ChemIDplus
glycine betaine monohydrate
ChEBI
trimethylammonioacetate monohydrate
ChEBI
Manual Xref
Database
Betaine
Wikipedia
View more database links
Registry Numbers
Types
Sources
3626258
Reaxys Registry Number
Reaxys
590-47-6
CAS Registry Number
ChemIDplus
Citation
Type
Source
19923702
PubMed citation
Europe PMC
Last Modified
17 February 2016