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5-Oxo-6-trans-leukotriene B4

PropertiesImage
MNX_IDMNXM38280 Image of MNXM38280
referencechebi:192149
formulaC20H30O4
global charge0
mol weight334.456
InChIKeyMLZJFLKEKVDNAZ-BEWISGCMSA-N
InChIInChI=1S/C20H30O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,18,21H,2-5,12-13,16-17H2,1H3,(H,23,24)/b8-7+,9-6-,14-10+,15-11+/t18-/m1/s1
SMILESCCCCC/C=C\C[C@@H](O)/C=C/C=C/C=C/C(=O)CCCC(=O)O
MNX internals
InChI (mnx)InChI=1/C20H30O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,18,21H,2-5,12-13,16-17H2,1H3,(H,23,24)/b8-7+,9-6-,14-10+,15-11+/t18-/m1/s1 Image of MNXM38280
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:6]=[CH:9]\[CH2:13][C@H:18](/[CH:14]=[CH:10]/[CH:7]=[CH:8]/[CH:11]=[CH:15]/[C:19]([CH2:16][CH2:12][CH2:17][C:20](=[O:23])[OH:24])=[O:22])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:192149
chebi:192149
MLZJFLKEKVDNAZ-BEWISGCMSA-N 		5-Oxo-6-trans-leukotriene B4
(6E,8E,10E,12R,14Z)-12-hydroxy-5-oxoicosa-6,8,10,14-tetraenoic acid
hmdb:HMDB0012824
MLZJFLKEKVDNAZ-BEWISGCMSA-N 		5-Oxo-6-trans-leukotriene B4
(12R)-Hydroxy-5-oxo-(6E,8E,10E,14Z)-eicosatetraenoate
(12R)-Hydroxy-5-oxo-(6E,8E,10E,14Z)-eicosatetraenoic acid
(6E,8E,10E,12R,14Z)-12-hydroxy-5-oxoicosa-6,8,10,14-tetraenoic acid
5-oxo-6E-LTB(,4)

lipidmaps:LMFA03020069
lipidmapsM:LMFA03020069
MLZJFLKEKVDNAZ-BEWISGCMSA-N 		5-Oxo-6-trans-leukotriene B4
(6E,8E,10E,12R,14Z)-12-hydroxy-5-oxoicosa-6,8,10,14-tetraenoic acid
FA 20:5
O2

bigg.metabolite:CE5178
biggM:CE5178
vmhM:CE5178
vmhmetabolite:CE5178
MLZJFLKEKVDNAZ-BEWISGCMSA-M 		5-oxo-6-trans-leukotriene B4

hmdb:HMDB0012825
hmdb:HMDB12824
hmdb:HMDB12825
biggM:M_CE5178
vmhM:M_CE5178 		secondary/obsolete/fantasy identifier