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ChEBI
> Main
CHEBI:63166 - leukotriene D
4
(1−)
Main
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ChEBI Name
leukotriene D
4
(1−)
ChEBI ID
CHEBI:63166
ChEBI ASCII Name
leukotriene D4(1-)
Definition
The leukotriene anion that is the monoanion of leukotriene D
4
arising from deprotonation of the two carboxy groups and protonation of the cysteinyl α-amino group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
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Molfile
Formula
C25H39N2O6S
Net Charge
-1
Average Mass
495.65300
Monoisotopic Mass
495.25343
InChI
InChI=1S/C25H40N2O6S/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
16-
22(21(28)
15-
14-
17-
23(29)
30)
34-
19-
20(26)
25(33)
27-
18-
24(31)
32/h6-
7,9-
13,16,20-
22,28H,2-
5,8,14-
15,17-
19,26H2,1H3,(H,27,33)
(H,29,30)
(H,31,32)
/p-
1/b7-
6-
,10-
9-
,12-
11+,16-
13+/t20-
,21-
,22+/m0/s1
InChIKey
YEESKJGWJFYOOK-IJHYULJSSA-M
SMILES
CCCCC\C=C/C\C=C/C=C/C=C/[C@@H](SC[C@H]([NH3+])C(=O)NCC([O-])=O)[C@@H](O)CCCC([O-])=O
ChEBI Ontology
Outgoing
leukotriene D
4
(1−) (
CHEBI:63166
)
is a
leukotriene anion (
CHEBI:62942
)
leukotriene D
4
(1−) (
CHEBI:63166
)
is a
peptide anion (
CHEBI:60334
)
leukotriene D
4
(1−) (
CHEBI:63166
)
is conjugate base of
leukotriene D
4
(
CHEBI:28666
)
Incoming
leukotriene D
4
(
CHEBI:28666
)
is conjugate acid of
leukotriene D
4
(1−) (
CHEBI:63166
)
IUPAC Names
(5
S
,6
R
,7
E
,9
E
,11
Z
,14
Z
)-
6-
({(2
R
)-
2-
amino-
3-
[(carboxylatomethyl)amino]-
3-
oxopropyl}sulfanyl)-
5-
hydroxyicosa-
7,9,11,14-
tetraenoate
S
-
{(1
R
,2
E
,4
E
,6
Z
,9
Z
)-
1-
[(1
S
)-
4-
carboxylato-
1-
hydroxybutyl]pentadeca-
2,4,6,9-
tetraen-
1-
yl}-
L
-
cysteinylglycinate
Synonyms
Sources
leukotriene D
4
UniProt
leukotriene D
4
anion
ChEBI
leukotriene D
4
monoanion
ChEBI
Last Modified
03 December 2015