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ChEBI
> Main
CHEBI:57973 - leukotriene C
4
(2−)
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ChEBI Name
leukotriene C
4
(2−)
ChEBI ID
CHEBI:57973
ChEBI ASCII Name
leukotriene C4(2-)
Definition
The leukotriene anion that is the dianion of leukotriene C
4
arising from deprotonation of the three carboxy groups and protonation of the glutamyl α-amino group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C30H45N3O9S
Net Charge
-2
Average Mass
623.75800
Monoisotopic Mass
623.28875
InChI
InChI=1S/C30H47N3O9S/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
16-
25(24(34)
15-
14-
17-
27(36)
37)
43-
21-
23(29(40)
32-
20-
28(38)
39)
33-
26(35)
19-
18-
22(31)
30(41)
42/h6-
7,9-
13,16,22-
25,34H,2-
5,8,14-
15,17-
21,31H2,1H3,(H,32,40)
(H,33,35)
(H,36,37)
(H,38,39)
(H,41,42)
/p-
2/b7-
6-
,10-
9-
,12-
11+,16-
13+/t22-
,23-
,24-
,25+/m0/s1
InChIKey
GWNVDXQDILPJIG-NXOLIXFESA-L
SMILES
CCCCC\C=C/C\C=C/C=C/C=C/[C@@H]
(SC[C@H]
(NC(=O)
CC[C@H]
([NH3+]
)
C([O-
]
)
=O)
C(=O)
NCC([O-
]
)
=O)
[C@@H]
(O)
CCCC([O-
]
)
=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
DOI
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
leukotriene C
4
(2−) (
CHEBI:57973
)
has role
human metabolite (
CHEBI:77746
)
leukotriene C
4
(2−) (
CHEBI:57973
)
is a
leukotriene anion (
CHEBI:62942
)
leukotriene C
4
(2−) (
CHEBI:57973
)
is a
peptide anion (
CHEBI:60334
)
leukotriene C
4
(2−) (
CHEBI:57973
)
is conjugate base of
leukotriene C
4
(
CHEBI:16978
)
Incoming
leukotriene C
4
(
CHEBI:16978
)
is conjugate acid of
leukotriene C
4
(2−) (
CHEBI:57973
)
IUPAC Name
(5
S
,6
R
,7
E
,9
E
,11
Z
,14
Z
)-
6-
({(2
R
)-
2-
{[(4
S
)-
4-
azaniumyl-
4-
carboxylatobutanoyl]amino}-
3-
[(carboxylatomethyl)amino]-
3-
oxopropyl}sulfanyl)-
5-
hydroxyicosa-
7,9,11,14-
tetraenoate
Synonyms
Sources
leukotriene C
4
UniProt
leukotriene C
4
dianion
ChEBI
Manual Xref
Database
LEUKOTRIENE-C4
MetaCyc
View more database links
Last Modified
03 December 2015