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13,14-dihydro-15-oxo-prostaglandin E2

MNXM2766 is deprecated and here replaced by MNXM733372
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM733372 Image of MNXM733372
referencechebi:57402
formulaC20H31O5
global charge-1
mol weight351.463
InChIKeyCUJMXIQZWPZMNQ-XYYGWQPLSA-M
InChIInChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,16-17,19,23H,2-3,5-6,8-14H2,1H3,(H,24,25)/p-1/b7-4-/t16-,17-,19-/m1/s1
SMILESCCCCCC(=O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,16-17,19,23H,2-3,5-6,8-14H2,1H3,(H,24,25)/b7-4-/t16-,17-,19-/m1/s1 Image of MNXM733372
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:6][CH2:9][C:15]([CH2:12][CH2:13][C@@H:17]1[C@@H:16]([CH2:10]/[CH:7]=[CH:4]\[CH2:5][CH2:8][CH2:11][C:20](=[O:24])[OH:25])[C:18](=[O:22])[CH2:14][C@H:19]1[OH:23])=[O:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57402
chebi:57402
CUJMXIQZWPZMNQ-XYYGWQPLSA-M 		13,14-dihydro-15-oxo-prostaglandin E2
(5Z)-11alpha-hydroxy-9,15-dioxoprost-5-enoate
13,14-dihydro-15-oxo-prostaglandin E2(1-)

seed.compound:cpd02845
seedM:cpd02845
CUJMXIQZWPZMNQ-XYYGWQPLSA-M 		(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate
(5Z)-(15S)-11-alpha-hydroxy-9,15-dioxoprostanoate
13,14-dihydro-15-oxo-prostaglandin E2

sabiork.compound:7479
sabiorkM:7479
CUJMXIQZWPZMNQ-XYYGWQPLSA-N 		(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate
13,14-Dihydro-15-keto-prostaglandin E2

kegg.compound:C04671
keggC:C04671
CUJMXIQZWPZMNQ-XYYGWQPLSA-N 		(5Z)-11alpha-Hydroxy-9,15-dioxoprostanoate
15-Keto-13,14-dihydroprostaglandin E2
hmdb:HMDB0002776
CUJMXIQZWPZMNQ-XYYGWQPLSA-N 		13,14-Dihydro-15-keto-PGE2
(5Z)-(15S)-11a-Hydroxy-9,15-dioxoprostanoate
(5Z)-(15S)-11a-Hydroxy-9,15-dioxoprostanoic acid
(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate
(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoic acid
(5Z)-(15S)-11alpha-hydroxy-9,15-dioxoprostanoate
(5Z)-(15S)-11alpha-hydroxy-9,15-dioxoprostanoic acid
(5Z)-7-[(1R,2R,3R)-3-hydroxy-5-oxo-2-(3-oxooctyl)cyclopentyl]hept-5-enoic acid
11-alpha-Hydroxy-9,15-dioxoprost-5-enoate
11-alpha-Hydroxy-9,15-dioxoprost-5-enoic acid
13,14-Dihydro-15-keto-pge2
13,14-Dihydro-15-ketoprostaglandin e2
15-Keto-13,14-dihydro-pge2
15-Keto-13,14-dihydroprostaglandin e2
15-Keto-13,14-dihydroprostaglandin e2, (11alpha)-isomer
DHK-PGE2
KH(2)PGE(2)
PGEM
PGEM (13,14-dihydro-15-keto-pge2)

lipidmaps:LMFA03010249
lipidmapsM:LMFA03010249
CUJMXIQZWPZMNQ-XYYGWQPLSA-N 		13,14-dihydro-15-keto-PGE2-d4
13,14-dihydro-15-keto-Prostaglandin E2-d4
9,15-dioxo-11R-hydroxy-5Z-prostenoic 3,3,4,4-d4 acid
9,15-dioxo-11alpha-hydroxy-prost-5Z-en-1-oic-3,3,4,4-d4 acid

lipidmaps:LMFA03010031
lipidmapsM:LMFA03010031
CUJMXIQZWPZMNQ-XYYGWQPLSA-N 		13,14-dihydro-15-keto-PGE2
13,14-dihydro-15-keto-Prostaglandin E2
9,15-dioxo-11R-hydroxy-5Z-prostenoic acid
FA 20:4
O3

SLM:000597635
slm:000597635
CUJMXIQZWPZMNQ-XYYGWQPLSA-M 		13,14-dihydro-15-oxo-prostaglandin E2

reactome:R-ALL-2142749
reactomeM:R-ALL-2142749
CHEBI:15550
chebi:15550
CUJMXIQZWPZMNQ-XYYGWQPLSA-N 		13,14-dihydro-15-oxo-prostaglandin E2
(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate
(5Z)-11alpha-hydroxy-9,15-dioxoprost-5-enoic acid
13,14-Dihydro-15-keto-PGE2
13,14-Dihydro-15-ketoprostaglandin E2
13,14-dihydro-15-keto-PGE2
15-Keto-13,14-dihydro-PGE2
15-Keto-13,14-dihydroprostaglandin E2
KH(2)PGE(2)
PGEM
dhk-PGE2

metacyc.compound:ALPHA-HYDROXY-915-DIOXOPROSTANOATE
metacycM:ALPHA-HYDROXY-915-DIOXOPROSTANOATE
CUJMXIQZWPZMNQ-XYYGWQPLSA-M 		15-dehydro-13,14-dihydro-prostaglandin E2
(5Z)-(15S)-11-alpha-hydroxy-9,15-dioxoprostanoate
13,14-dihydro-15-keto-prostaglandin E2
13,14-dihydro-15-oxo-prostaglandin E2
PGEM

hmdb:HMDB0011650
hmdb:HMDB02776
hmdb:HMDB11650
chebi:10909
chebi:244
keggC:M_C04671
seedM:M_cpd02845 		secondary/obsolete/fantasy identifier