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> Main
CHEBI:83353 - eliglustat tartrate
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ChEBI Name
eliglustat tartrate
ChEBI ID
CHEBI:83353
Definition
A tartrate that is the hemitartrate salt of eliglustat. A ceramide glucosyltransferase inhibitor used (as its tartrate salt) for treatment of Gaucher's disease.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C50H78N4O14
Net Charge
0
Average Mass
959.17270
Monoisotopic Mass
958.55145
InChI
InChI=1S/2C23H36N2O4.C4H6O6/c2*1-
2-
3-
4-
5-
6-
9-
22(26)
24-
19(17-
25-
12-
7-
8-
13-
25)
23(27)
18-
10-
11-
20-
21(16-
18)
29-
15-
14-
28-
20;5-
1(3(7)
8)
2(6)
4(9)
10/h2*10-
11,16,19,23,27H,2-
9,12-
15,17H2,1H3,(H,24,26)
;1-
2,5-
6H,(H,7,8)
(H,9,10)
/t2*19-
,23-
;1-
,2-
/m111/s1
InChIKey
KUBARPMUNHKBIQ-VTHUDJRQSA-N
SMILES
O[C@H]
([C@@H]
(O)
C(O)
=O)
C(O)
=O.CCCCCCCC(=O)
N[C@H]
(CN1CCCC1)
[C@H]
(O)
c1ccc2OCCOc2c1.CCCCCCCC(=O)
N[C@H]
(CN1CCCC1)
[C@H]
(O)
c1ccc2OCCOc2c1
Roles Classification
Biological Role
(s):
EC 2.4.1.80 (ceramide glucosyltransferase) inhibitor
An EC 2.4.1.* (hexosyltransferase) inhibitor that interferes with the activity of ceramide glucosyltransferase (EC 2.4.1.80).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
eliglustat tartrate (
CHEBI:83353
)
has part
eliglustat(1+) (
CHEBI:83355
)
eliglustat tartrate (
CHEBI:83353
)
has role
EC 2.4.1.80 (ceramide glucosyltransferase) inhibitor (
CHEBI:50382
)
eliglustat tartrate (
CHEBI:83353
)
is a
tartrate salt (
CHEBI:50562
)
IUPAC Names
bis{1-
[(2
R
,3
R
)-
3-
(2,3-
dihydro-
1,4-
benzodioxin-
6-
yl)-
3-
hydroxy-
2-
(octanoylamino)propyl]pyrrolidinium} (2
R
,3
R
)-
2,3-
dihydroxysuccinate
bis{
N
-
[(1
R
,2
R
)-
1-
(2,3-
dihydro-
1,4-
benzodioxin-
6-
yl)-
1-
hydroxy-
3-
(pyrrolidin-
1-
yl)propan-
2-
yl]octanamide} (2
R
,3
R
)-
2,3-
dihydroxysuccinic acid
Synonyms
Sources
eliglustat hemitartrate
ChEBI
eliglustat
L
-tartrate
ChEBI
Genz-112638
ChemIDplus
Brand Name
Source
Cerdelga
ChemIDplus
Manual Xrefs
Databases
D09894
KEGG DRUG
Eliglustat
Wikipedia
View more database links
Registry Numbers
Types
Sources
21475296
Reaxys Registry Number
Reaxys
928659-70-5
CAS Registry Number
KEGG DRUG
928659-70-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
17509920
PubMed citation
Europe PMC
20439622
PubMed citation
Europe PMC
20713962
PubMed citation
Europe PMC
20864621
PubMed citation
Europe PMC
20872320
PubMed citation
Europe PMC
22563139
PubMed citation
Europe PMC
23874009
PubMed citation
Europe PMC
24259734
PubMed citation
Europe PMC
25239269
PubMed citation
Europe PMC
25256118
PubMed citation
Europe PMC
Last Modified
20 October 2014