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12-hydroxyeicosatetraenoate

MNXM13980 is deprecated and here replaced by MNXM1368130
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368130 Image of MNXM1368130
referencebiggM:CE0347
formulaC20H31O3
global charge-1
mol weight319.465
InChIKeyZNHVWPKMFKADKW-FYMOKONMSA-M
InChIInChI=1S/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/p-1/b9-7+,11-8-,13-10-,17-14-
SMILESCCCCC/C=C\CC(O)/C=C\C=C/C/C=C/CCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/b9-7+,11-8-,13-10-,17-14-/t19? Image of MNXM1368130
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:10]=[CH:13]\[CH2:16][CH:19](/[CH:17]=[CH:14]\[CH:11]=[CH:8]/[CH2:6]/[CH:7]=[CH:9]/[CH2:12][CH2:15][CH2:18][C:20](=[O:22])[OH:23])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 8
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:CE0347
biggM:CE0347
vmhM:CE0347
vmhmetabolite:CE0347
ZNHVWPKMFKADKW-FYMOKONMSA-M 		12-hydroxyeicosatetraenoate

lipidmaps:LMFA03060063
lipidmapsM:LMFA03060063
ZNHVWPKMFKADKW-FYMOKONMSA-N 		12-hydroxy-5E,8Z,10Z,14Z-eicosatetraenoic acid
12-HETE
12-Hydroxy-5,8,10,14-eicosatetraenoic acid
12-Hydroxyeicosatetraenoic acid
12-hydroxy-5E,8Z,10Z,14Z-eicosatetraenoic acid
5,8,10,14-Eicosatetraenoic acid, 12-hydroxy-, (E,Z,Z,Z)-
FA 20:4
O

biggM:M_CE0347
vmhM:M_CE0347 		secondary/obsolete/fantasy identifier