Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:85166 - prostaglandin H
2
2-glyceryl ester
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
prostaglandin H
2
2-glyceryl ester
ChEBI ID
CHEBI:85166
ChEBI ASCII Name
prostaglandin H2 2-glyceryl ester
Definition
A 2-monoglyceride obtained by formal condensation of the carboxy group of prostaglandin H
2
with the 2-hydroxy group of glycerol.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C23H38O7
Net Charge
0
Average Mass
426.54360
Monoisotopic Mass
426.26175
InChI
InChI=1S/C23H38O7/c1-
2-
3-
6-
9-
17(26)
12-
13-
20-
19(21-
14-
22(20)
30-
29-
21)
10-
7-
4-
5-
8-
11-
23(27)
28-
18(15-
24)
16-
25/h4,7,12-
13,17-
22,24-
26H,2-
3,5-
6,8-
11,14-
16H2,1H3/b7-
4-
,13-
12+/t17-
,19+,20+,21-
,22+/m0/s1
InChIKey
XWDRGTGPJCBPGC-PKBBWAGBSA-N
SMILES
CCCCC[C@H](O)\C=C\[C@H]1[C@H]2C[C@H](OO2)[C@@H]1C\C=C/CCCC(=O)OC(CO)CO
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Chemical Role
(s):
oxidising agent
A substance that removes electrons from another reactant in a redox reaction.
(via
peroxides
)
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
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
has functional parent
prostaglandin H
2
(
CHEBI:15554
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
has role
human metabolite (
CHEBI:77746
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
is a
2-monoglyceride (
CHEBI:17389
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
is a
bridged compound (
CHEBI:35990
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
is a
olefinic compound (
CHEBI:78840
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
is a
organic peroxide (
CHEBI:25702
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
is a
prostaglandins H (
CHEBI:26344
)
prostaglandin H
2
2-glyceryl ester (
CHEBI:85166
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
1,3-
dihydroxypropan-
2-
yl (5
Z
)-
7-
{(1
R
,4
S
,5
R
,6
R
)-
6-
[(1
E
,3
S
)-
3-
hydroxyoct-
1-
en-
1-
yl]-
2,3-
dioxabicyclo[2.2.1]heptan-
5-
yl}hept-
5-
enoate
Synonyms
Sources
1,3-
dihydroxypropan-
2-
yl (5
Z
,9
S
,11
R
,13
E
,15
S
)-
15-
hydroxy-
9,11-
epidioxyprosta-
5,13-
dien-
1-
oate
ChEBI
2-glyceryl-prostaglandin H
2
UniProt
Citation
Type
Source
22942274
PubMed citation
SUBMITTER
Last Modified
21 February 2017