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12(S)-HPETE

MNXM2765 is deprecated and here replaced by MNXM1368928
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368928 Image of MNXM1368928
referencehmdb:HMDB0004243
formulaC20H32O4
global charge0
mol weight336.472
InChIKeyZIOZYRSDNLNNNJ-LQWMCKPYSA-N
InChIInChI=1S/C20H32O4/c1-2-3-4-5-10-13-16-19(24-23)17-14-11-8-6-7-9-12-15-18-20(21)22/h7-11,13-14,17,19,23H,2-6,12,15-16,18H2,1H3,(H,21,22)/b9-7-,11-8-,13-10-,17-14+/t19-/m0/s1
SMILESCCCCC/C=C\C[C@@H](/C=C/C=C\C/C=C\CCCC(=O)O)OO
MNX internals
InChI (mnx)InChI=1/C20H32O4/c1-2-3-4-5-10-13-16-19(24-23)17-14-11-8-6-7-9-12-15-18-20(21)22/h7-11,13-14,17,19,23H,2-6,12,15-16,18H2,1H3,(H,21,22)/b9-7-,11-8-,13-10-,17-14+/t19-/m0/s1 Image of MNXM1368928
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:10]=[CH:13]\[CH2:16][C@@H:19](/[CH:17]=[CH:14]/[CH:11]=[CH:8]\[CH2:6]/[CH:7]=[CH:9]\[CH2:12][CH2:15][CH2:18][C:20](=[O:21])[OH:22])[O:24][OH:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0004243
ZIOZYRSDNLNNNJ-LQWMCKPYSA-N 		12(S)-HPETE
(5Z,8Z,10E,12S,14Z)-12-Hydroperoxyicosa-5,8,10,14-tetraenoate
(5Z,8Z,10E,12S,14Z)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid
(5Z,8Z,10E,12S,14Z)-12-hydroperoxyicosa-5,8,10,14-tetraenoic acid
(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyeicosa-5,8,10,14-tetraenoate
(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyeicosa-5,8,10,14-tetraenoic acid
(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoate
(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid
12-HPETE, (S-(e,Z,Z,Z))-isomer
12-HPETE, (S-(e,e,e))-isomer
12-HPETE, (e,Z,Z,Z)-isomer
12-HpETE
12-Hydroperoxy-5,8,10,14-icosatetraenoic acid
12-Hydroperoxyeicosatetraenoate
12-Hydroperoxyeicosatetraenoic acid
12-Hydroperoxyicosatetraenoate
12-Hydroperoxyicosatetraenoic acid
12-L-Hydroperoxy-5,8,10,14-eicosatetraenoic acid
12-Oohete
Arachidonate omega-9 hydroperoxide
Arachidonic acid omega-9 hydroperoxide
Omega-9 hpaa
Omega-9-hydroperoxyarachidonate
Omega-9-hydroperoxyarachidonic acid

vmhM:C05965
vmhmetabolite:C05965
ZIOZYRSDNLNNNJ-LQWMCKPYSA-N 		12(S)-HPETE(1-)
4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

hmdb:HMDB04243
vmhM:M_C05965 		secondary/obsolete/fantasy identifier