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ChEBI
> Main
CHEBI:16461 - tauropine
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ChEBI Name
tauropine
ChEBI ID
CHEBI:16461
Definition
A derivative of
L
-alanine having a 2-sulfoethyl group attached to the α-nitrogen.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:9413, CHEBI:26860, CHEBI:15201
Supplier Information
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Molfile
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Molfile
Formulae
C5H11NO5S
C5H11NO5S
Net Charge
0
Average Mass
197.21000
Monoisotopic Mass
197.03579
InChI
InChI=1S/C5H11NO5S/c1-4(5(7)8)6-2-3-12(9,10)11/h4,6H,2-3H2,1H3,(H,7,8)(H,9,10,11)/t4-/m1/s1
InChIKey
VHYQDLYSULDZSO-SCSAIBSYSA-N
SMILES
C[C@@H](NCCS(O)(=O)=O)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
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
tauropine (
CHEBI:16461
)
has functional parent
taurine (
CHEBI:15891
)
tauropine (
CHEBI:16461
)
is a
D
-α-amino acid (
CHEBI:16733
)
tauropine (
CHEBI:16461
)
is a
D
-alanine derivative (
CHEBI:83944
)
tauropine (
CHEBI:16461
)
is a
organosulfonic acid (
CHEBI:33551
)
tauropine (
CHEBI:16461
)
is conjugate acid of
tauropinate(1−) (
CHEBI:57779
)
Incoming
tauropinate(1−) (
CHEBI:57779
)
is conjugate base of
tauropine (
CHEBI:16461
)
IUPAC Name
N
-(2-sulfoethyl)-
D
-alanine
Synonyms
Sources
N
-(1-carboxyethyl)taurine
ChemIDplus
N
2
-(
D
-1-carboxyethyl)-2-aminoethanesulfonate
IUBMB
N2-(D-1-Carboxyethyl)taurine
KEGG COMPOUND
rhodoic acid
ChemIDplus
Tauropine
KEGG COMPOUND
Manual Xref
Database
C01616
KEGG COMPOUND
View more database links
Registry Number
Type
Source
33497-79-9
CAS Registry Number
ChemIDplus
Last Modified
01 December 2014