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prostaglandin A1

MNXM4788 is deprecated and here replaced by MNXM1108266
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108266 Image of MNXM1108266
referencechebi:57398
formulaC20H31O4
global charge-1
mol weight335.464
InChIKeyBGKHCLZFGPIKKU-LDDQNKHRSA-M
InChIInChI=1S/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12-18,21H,2-11H2,1H3,(H,23,24)/p-1/b14-12+/t16-,17-,18+/m0/s1
SMILESCCCCC[C@H](O)/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12-18,21H,2-11H2,1H3,(H,23,24)/b14-12+/t16-,17-,18+/m0/s1 Image of MNXM1108266
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:6][CH2:9][C@@H:17](/[CH:14]=[CH:12]/[C@H:16]1[CH:13]=[CH:15][C:19](=[O:22])[C@@H:18]1[CH2:10][CH2:7][CH2:4][CH2:5][CH2:8][CH2:11][C:20](=[O:23])[OH:24])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)11
in models (compartimentalized) 13
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57398
chebi:57398
BGKHCLZFGPIKKU-LDDQNKHRSA-M 		prostaglandin A1
(13E,15S)-15-hydroxy-9-oxoprosta-10,13-dien-1-oate
prostaglandin A1 anion
prostaglandin A1(1-)

kegg.compound:C04685
keggC:C04685
BGKHCLZFGPIKKU-BGEXMHJYSA-N 		(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate
PGA1
Prostaglandin A1

seed.compound:cpd02853
seedM:cpd02853
BGKHCLZFGPIKKU-XBUWFATQSA-M 		PGA1
(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate
(13E)-(15S)-15-hydroxy-9-oxoprosta-10,13-dienoate
Prostaglandin A1
prostaglandin A1

lipidmaps:LMFA03010005
lipidmapsM:LMFA03010005
BGKHCLZFGPIKKU-LDDQNKHRSA-N 		PGA1
15a-Hydroxy-9-oxo-10,13E-prostadienoate
15a-Hydroxy-9-oxo-10,13E-prostadienoic acid
9-oxo-15S-hydroxy-10Z,13E-prostadienoic acid
FA 20:4
O2
Prostaglandin A1

bigg.metabolite:HC02202
biggM:HC02202
BGKHCLZFGPIKKU-LDDQNKHRSA-M 		Prostaglandin A1(1-)
hmdb:HMDB0002656
BGKHCLZFGPIKKU-LDDQNKHRSA-N 		Prostaglandin A1
(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate
(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoic acid
(13E,15S)-15-Hydroxy-9-oxo-prosta-10,13-dien-1-Oate
(13E,15S)-15-Hydroxy-9-oxo-prosta-10,13-dien-1-Oic acid
15-Hydroxy-9-oxoprosta-10,13-dienoate
15-Hydroxy-9-oxoprosta-10,13-dienoic acid
15a-Hydroxy-9-ketoprosta-10,13-dienoate
15a-Hydroxy-9-ketoprosta-10,13-dienoic acid
15a-Hydroxy-9-oxo-10,13E-prostadienoate
15a-Hydroxy-9-oxo-10,13E-prostadienoic acid
2-(3-Hydroxy-1-octenyl)-5-oxo-3- cyclopentene-1-heptanoate
2-(3-Hydroxy-1-octenyl)-5-oxo-3- cyclopentene-1-heptanoic acid
2-(3-Hydroxy-1-octenyl)-5-oxo-3-cyclopentene-1-heptanoate
2-(3-Hydroxy-1-octenyl)-5-oxo-3-cyclopentene-1-heptanoic acid
7-[(1R,2S)-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopent-3-en-1-yl]heptanoic acid
PGA1
Prostaglandin a1
Prostaglandin a1, (13E,15R)-(+-)-isomer
Prostaglandin a1, (13E,15R)-isomer
Prostaglandin a1, (13E,15S)-(+-)-isomer
Prostaglandin a1, (8beta,12alpha,13E,15S)-isomer
Prostaglandin e1-217
prostaglandin A1

SLM:000390067
slm:000390067
BGKHCLZFGPIKKU-LDDQNKHRSA-M 		Prostaglandin A1
PGA1

vmhM:C04685
vmhmetabolite:C04685
BGKHCLZFGPIKKU-LDDQNKHRSA-N 		prostaglandin A1(1-)
4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

vmhM:HC02202
vmhmetabolite:HC02202
BGKHCLZFGPIKKU-LDDQNKHRSA-M 		prostaglandin A1(1-)
7-[(1R,2S)-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopent-3-en-1-yl]heptanoic acid

CHEBI:15545
chebi:15545
BGKHCLZFGPIKKU-LDDQNKHRSA-N 		prostaglandin A1
(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate
(13E,15S)-15-hydroxy-9-oxoprosta-10,13-dien-1-oic acid
PGA1
Prostaglandin A1

metacyc.compound:CPD-1911
metacycM:CPD-1911
BGKHCLZFGPIKKU-XBUWFATQSA-M 		prostaglandin A1
(13E)-(15S)-15-hydroxy-9-oxoprosta-10,13-dienoate
PGA1

hmdb:HMDB02656
chebi:10821
chebi:143
chebi:26314
biggM:M_HC02202
keggC:M_C04685
seedM:M_cpd02853
vmhM:M_C04685
vmhM:M_HC02202 		secondary/obsolete/fantasy identifier