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6,7-dihydro-5-oxo-leukotriene B4

MNXM162494 is deprecated and here replaced by MNXM1107222
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1107222 Image of MNXM1107222
referencebiggM:CE5179
formulaC20H31O4
global charge-1
mol weight335.464
InChIKeyRUTQOBJLGHUCJC-GOSISDBHSA-M
InChIInChI=1S/C20H32O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-10,14,18,21H,2-5,11-13,15-17H2,1H3,(H,23,24)/p-1/t18-/m1/s1
SMILESCCCCCC=CC[C@@H](O)C=CC=CCCC(=O)CCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C20H32O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-10,14,18,21H,2-5,11-13,15-17H2,1H3,(H,23,24)/b8-7?,9-6?,14-10?/t18-/m1/s1 Image of MNXM1107222
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][CH2:11][CH2:15][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)4
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:CE5179
biggM:CE5179
vmhM:CE5179
vmhmetabolite:CE5179
RUTQOBJLGHUCJC-GOSISDBHSA-M 		6,7-dihydro-5-oxo-leukotriene B4

biggM:M_CE5179
vmhM:M_CE5179 		secondary/obsolete/fantasy identifier