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ChEBI
> Main
CHEBI:61781 - tripalmitoyl-
S
-glyceryl-cysteinyl-seryl-serine
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ChEBI Ontology
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ChEBI Name
tripalmitoyl-
S
-glyceryl-cysteinyl-seryl-serine
ChEBI ID
CHEBI:61781
ChEBI ASCII Name
tripalmitoyl-S-glyceryl-cysteinyl-seryl-serine
Definition
A triacyl lipopeptide consisting of the tripeptide
L
-cysteinyl-
L
-seryl-
L
-serine with the cysteinyl residue carrying
N
-palmitoyl and
S
-2,3-bis(palmitoyloxy)propyl groups.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C60H113N3O11S
Net Charge
0
Average Mass
1084.61800
Monoisotopic Mass
1083.80958
InChI
InChI=1S/C60H113N3O11S/c1-
4-
7-
10-
13-
16-
19-
22-
25-
28-
31-
34-
37-
40-
43-
55(66)
61-
54(59(70)
62-
52(46-
64)
58(69)
63-
53(47-
65)
60(71)
72)
50-
75-
49-
51(74-
57(68)
45-
42-
39-
36-
33-
30-
27-
24-
21-
18-
15-
12-
9-
6-
3)
48-
73-
56(67)
44-
41-
38-
35-
32-
29-
26-
23-
20-
17-
14-
11-
8-
5-
2/h51-
54,64-
65H,4-
50H2,1-
3H3,(H,61,66)
(H,62,70)
(H,63,69)
(H,71,72)
/t51?,52-
,53-
,54-
/m0/s1
InChIKey
XVQKZSLOGHBCET-INVHGPFASA-N
SMILES
CCCCCCCCCCCCCCCC(=O)
N[C@@H]
(CSCC(COC(=O)
CCCCCCCCCCCCCCC)
OC(=O)
CCCCCCCCCCCCCCC)
C(=O)
N[C@@H]
(CO)
C(=O)
N[C@@H]
(CO)
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
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
tripalmitoyl-
S
-glyceryl-cysteinyl-seryl-serine (
CHEBI:61781
)
is a
triacyl lipopeptide (
CHEBI:60192
)
IUPAC Name
S
-
[2,3-
bis(hexadecanoyloxy)propyl]-
N
-
hexadecanoyl-
L
-
cysteinyl-
L
-
seryl-
L
-
serine
Synonyms
Sources
N-Palmitoyl-5,6-dipalmitoyl-S-glycerylcysteinyl-seryl-serine
ChemIDplus
N
-palmitoyl-
S
-[2,3-bis(palmitoyloxy)propyl]-cysteinyl-seryl-serine
ChEBI
P
3
CSS
ChEBI
S
-
[2,3-
bis(palmitoyloxy)propyl]-
N
-
palmitoyl-
L
-
cysteinyl-
L
-
seryl-
L
-
serine
ChEBI
tripalmitoyl-
S
-glyceryl-Cys-Ser-Ser
ChEBI
Registry Numbers
Types
Sources
15383379
Reaxys Registry Number
Reaxys
98633-82-0
CAS Registry Number
ChemIDplus
Citation
Type
Source
2470437
PubMed citation
Europe PMC
Last Modified
05 April 2011