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12-oxo-20-dihydroxy-leukotriene B4

PropertiesImage
MNX_IDMNXM33277 Image of MNXM33277
referencechebi:175707
formulaC20H30O6
global charge0
mol weight366.454
InChIKeySBSLZLBZGOASJL-NZXMSVEXSA-N
InChIInChI=1S/C20H30O6/c21-17(11-6-2-1-3-9-15-19(23)24)12-7-4-5-8-13-18(22)14-10-16-20(25)26/h2,4-8,12-13,18-19,22-24H,1,3,9-11,14-16H2,(H,25,26)/b5-4+,6-2-,12-7+,13-8-/t18-/m0/s1
SMILESO=C(O)CCC[C@@H](O)/C=C\C=C\C=C\C(=O)C/C=C\CCCCC(O)O
MNX internals
InChI (mnx)InChI=1/C20H30O6/c21-17(11-6-2-1-3-9-15-19(23)24)12-7-4-5-8-13-18(22)14-10-16-20(25)26/h2,4-8,12-13,18-19,22-24H,1,3,9-11,14-16H2,(H,25,26)/b5-4+,6-2-,12-7+,13-8-/t18-/m0/s1 Image of MNXM33277
SMILES (mnx)[CH2:1](/[CH:2]=[CH:6]\[CH2:11][C:17](/[CH:12]=[CH:7]/[CH:4]=[CH:5]/[CH:8]=[CH:13]\[C@@H:18]([CH2:14][CH2:10][CH2:16][C:20](=[O:25])[OH:26])[OH:22])=[O:21])[CH2:3][CH2:9][CH2:15][CH:19]([OH:23])[OH:24]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:175707
chebi:175707
SBSLZLBZGOASJL-NZXMSVEXSA-N 		12-oxo-20-dihydroxy-leukotriene B4
(5R,6Z,8E,10E,14Z)-5,20,20-trihydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid

bigg.metabolite:CE5139
biggM:CE5139
vmhM:CE5139
vmhmetabolite:CE5139
SBSLZLBZGOASJL-NZXMSVEXSA-M 		12-oxo-20-dihydroxy-leukotriene B4
hmdb:HMDB0012551
SBSLZLBZGOASJL-NZXMSVEXSA-N 		12-oxo-20-dihydroxy-leukotriene B4
(5R,6Z,8E,10E,14Z)-5,20,20-trihydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid
(5S,20,20)-Trihydroxy-12-keto-(6Z,8E,10E,14Z)-eicosatetraenoate
(5S,20,20)-Trihydroxy-12-keto-(6Z,8E,10E,14Z)-eicosatetraenoic acid
(5S,20,20)-Trihydroxy-12-oxo-(6Z,8E,10E,14Z)-eicosatetraenoate
(5S,20,20)-Trihydroxy-12-oxo-(6Z,8E,10E,14Z)-eicosatetraenoic acid
12-keto-20,20-Dihydroxy-leukotriene b(,4)
12-oxo-20,20-Dihydroxy-leukotriene b(,4)
Ox20dHLTB4

lipidmaps:LMFA03020048
lipidmapsM:LMFA03020048
SBSLZLBZGOASJL-NZXMSVEXSA-N 		12-oxo-20-dihydroxy-leukotriene B4
(5R,6Z,8E,10E,14Z)-5,20,20-trihydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid
FA 20:5
O4

hmdb:HMDB12551
biggM:M_CE5139
vmhM:M_CE5139 		secondary/obsolete/fantasy identifier