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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:34821 - levuglandin E
2
Main
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ChEBI Name
levuglandin E
2
ChEBI ID
CHEBI:34821
ChEBI ASCII Name
levuglandin E2
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C20H32O5
Net Charge
0
Average Mass
352.46508
Monoisotopic Mass
352.22497
InChI
InChI=1S/C20H32O5/c1-
3-
4-
7-
10-
18(23)
14-
13-
17(15-
21)
19(16(2)
22)
11-
8-
5-
6-
9-
12-
20(24)
25/h5,8,13-
15,17-
19,23H,3-
4,6-
7,9-
12H2,1-
2H3,(H,24,25)
/b8-
5-
,14-
13+/t17-
,18-
,19-
/m0/s1
InChIKey
WJWAORNTZNRHBP-QNUMDXCLSA-N
SMILES
CCCCC[C@H](O)\C=C\[C@@H](C=O)[C@@H](C\C=C/CCCC(O)=O)C(C)=O
ChEBI Ontology
Outgoing
levuglandin E
2
(
CHEBI:34821
)
is a
levuglandin (
CHEBI:36142
)
Incoming
L
-lysyl levuloglandin E
2
adduct (
CHEBI:140823
)
has functional parent
levuglandin E
2
(
CHEBI:34821
)
IUPAC Names
(5
Z
,13
E
,15
S
)-15-hydroxy-9,11-dioxo-10,11-secoprosta-5,13-dienoate
(5
Z
,8
R
,9
R
,10
E
,12
S
)-
8-
acetyl-
9-
formyl-
12-
hydroxyheptadeca-
5,10-
dienoic acid
Synonyms
Sources
10,11-Seco-9,11-dioxo-15S-hydroxy-5Z,13E-prostadienoate
KEGG COMPOUND
10,11-Seco-9,11-dioxo-15S-hydroxy-5Z,13E-prostadienoic acid
KEGG COMPOUND
Levuglandin E2
KEGG COMPOUND
LGE2
KEGG COMPOUND
Manual Xrefs
Databases
C13807
KEGG COMPOUND
HMDB0002363
HMDB
LMFA03100001
LIPID MAPS
View more database links
Registry Number
Type
Source
91712-41-3
CAS Registry Number
ChemIDplus
Last Modified
23 May 2018