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ChEBI
> Main
CHEBI:60366 - 1-(3-
O
-sulfo-β-
D
-galactosyl)-
N
-palmitoylsphingosine
Main
ChEBI Ontology
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ChEBI Name
1-(3-
O
-sulfo-β-
D
-galactosyl)-
N
-palmitoylsphingosine
ChEBI ID
CHEBI:60366
ChEBI ASCII Name
1-(3-O-sulfo-beta-D-galactosyl)-N-palmitoylsphingosine
Definition
A
D
-galactosyl-
N
-acylsphingosine having a sulfo group at the 3-position on the galactose ring and palmitoyl as the
N
-acyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C40H77NO11S
Net Charge
0
Average Mass
780.10400
Monoisotopic Mass
779.52173
InChI
InChI=1S/C40H77NO11S/c1-
3-
5-
7-
9-
11-
13-
15-
17-
19-
21-
23-
25-
27-
29-
34(43)
33(32-
50-
40-
38(46)
39(52-
53(47,48)
49)
37(45)
35(31-
42)
51-
40)
41-
36(44)
30-
28-
26-
24-
22-
20-
18-
16-
14-
12-
10-
8-
6-
4-
2/h27,29,33-
35,37-
40,42-
43,45-
46H,3-
26,28,30-
32H2,1-
2H3,(H,41,44)
(H,47,48,49)
/b29-
27+/t33-
,34+,35+,37-
,38+,39-
,40+/m0/s1
InChIKey
CJGVDSGIQZDLDO-PHLJAKBWSA-N
SMILES
CCCCCCCCCCCCCCCC(=O)
N[C@@H]
(CO[C@@H]
1O[C@H]
(CO)
[C@H]
(O)
[C@H]
(OS(O)
(=O)
=O)
[C@H]
1O)
[C@H]
(O)
\C=C\CCCCCCCCCCCCC
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
(via
N-acyl-beta-D-galactosylsphingosine
)
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
(via
galactosylceramide sulfate
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1-(3-
O
-sulfo-β-
D
-galactosyl)-
N
-palmitoylsphingosine (
CHEBI:60366
)
is a
N
-acyl-β-
D
-galactosylsphingosine (
CHEBI:18390
)
1-(3-
O
-sulfo-β-
D
-galactosyl)-
N
-palmitoylsphingosine (
CHEBI:60366
)
is a
galactosylceramide sulfate (
CHEBI:18318
)
IUPAC Name
N
-
{(2
S
,3
R
,4
E
)-
3-
hydroxy-
1-
[(3-
O
-
sulfo-
β-
D
-
galactopyranosyl)oxy]octadec-
4-
en-
2-
yl}hexadecanamide
Synonyms
Sources
(3'-sulfo)Galβ-Cer(d18:1/16:0)
LIPID MAPS
1-(3-
O
-sulfo-β-
D
-galactosyl)-
N
-hexadecanoylsphingosine
ChEBI
C16 Sulfatide
LIPID MAPS
sulfatide C
16:0
ChEBI
Manual Xrefs
Databases
HMDB0012313
HMDB
LMSP06020002
LIPID MAPS
View more database links
Citations
Types
Sources
16314439
PubMed citation
Europe PMC
22820602
PubMed citation
Europe PMC
Last Modified
31 January 2013