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12-Keto-tetrahydro-LTB4

PropertiesImage
MNX_IDMNXM33271 Image of MNXM33271
referencechebi:165291
formulaC20H34O4
global charge0
mol weight338.488
InChIKeyRRTYEHFGQWNQKK-KIQAWMAPSA-N
InChIInChI=1S/C20H34O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h7-8,11,15,19,22H,2-6,9-10,12-14,16-17H2,1H3,(H,23,24)/b8-7+,15-11-/t19-/m1/s1
SMILESCCCCCCCCC(=O)CC/C=C/C=C\[C@@H](O)CCCC(=O)O
MNX internals
InChI (mnx)InChI=1/C20H34O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h7-8,11,15,19,22H,2-6,9-10,12-14,16-17H2,1H3,(H,23,24)/b8-7+,15-11-/t19-/m1/s1 Image of MNXM33271
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:9][CH2:13][C:18]([CH2:14][CH2:10]/[CH:7]=[CH:8]/[CH:11]=[CH:15]\[C@H:19]([CH2:16][CH2:12][CH2:17][C:20](=[O:23])[OH:24])[OH:22])=[O:21]
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

CHEBI:165291
chebi:165291
RRTYEHFGQWNQKK-KIQAWMAPSA-N 		12-Keto-tetrahydro-LTB4
(5S,6Z,8E)-5-hydroxy-12-oxoicosa-6,8-dienoic acid
hmdb:HMDB0002995
RRTYEHFGQWNQKK-KIQAWMAPSA-N 		12-Keto-tetrahydro-leukotriene B4
(5S,6Z,8E)-5-hydroxy-12-oxoicosa-6,8-dienoic acid
12-Keto-10,11,14,15-tetrahydro-LTB4
5S-Hydroxy-12-keto-6Z,8E-eicosadienoate
5S-Hydroxy-12-keto-6Z,8E-eicosadienoic acid
leukotriene B

lipidmaps:LMFA03020004
lipidmapsM:LMFA03020004
RRTYEHFGQWNQKK-KIQAWMAPSA-N 		12-keto-10,11,14,15-tetrahydro-LTB4
12-keto-10,11,14,15-tetrahydro-Leukotriene B4
5S-hydroxy-12-keto-6Z,8E-eicosadienoic acid
FA 20:3
O2

hmdb:HMDB02995 		secondary/obsolete/fantasy identifier