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10,11-dihydro-12-oxo-LTB4

PropertiesImage
MNX_IDMNXM33026 Image of MNXM33026
referencechebi:175292
formulaC20H32O4
global charge0
mol weight336.472
InChIKeyAHHXLFNPCWCNQF-SOOJVSLFSA-N
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/h6-9,11,15,19,22H,2-5,10,12-14,16-17H2,1H3,(H,23,24)/b8-7+,9-6-,15-11-/t19-/m0/s1
SMILESCCCCC/C=C\CC(=O)CC/C=C/C=C\[C@H](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/h6-9,11,15,19,22H,2-5,10,12-14,16-17H2,1H3,(H,23,24)/b8-7+,9-6-,15-11-/t19-/m0/s1 Image of MNXM33026
SMILES (mnx)[CH3:1][C@H:11]([CH2:7][CH2:9][CH2:12][O:23]([CH3:3])=[CH2:4])/[CH:16]=[O:21]/[O:24]=[O:22]/[CH2:19][CH2:17][C:20](=[CH2:2])[CH2:15]/[CH:18]=[CH:13]\[CH2:8][CH2:5][CH2:6][CH2:10][CH3:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 8
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:175292
chebi:175292
AHHXLFNPCWCNQF-SOOJVSLFSA-N
10,11-dihydro-12-oxo-LTB4
(5R,6Z,8E,14Z)-5-hydroxy-12-oxoicosa-6,8,14-trienoic acid

bigg.metabolite:CE5944
biggM:CE5944
vmhM:CE5944
vmhM:CE5944
vmhmetabolite:CE5944
vmhmetabolite:CE5944
AHHXLFNPCWCNQF-SOOJVSLFSA-M
10,11-dihydro-12-oxo-LTB4
hmdb:HMDB0012498
AHHXLFNPCWCNQF-SOOJVSLFSA-N
10,11-dihydro-12-oxo-LTB4
(5R,6Z,8E,14Z)-5-hydroxy-12-oxoicosa-6,8,14-trienoic acid
12-oxo-(5S)-Hydroxy-(6Z,8E,14Z)-eicosatrienoate
12-oxo-(5S)-Hydroxy-(6Z,8E,14Z)-eicosatrienoic acid
12-oxo-(5S)-Hydroxy-(6Z,8E,14Z)-eicosatrienoic acid anion
12-oxo-10,11-dihydro-LTB(,4)

lipidmaps:LMFA03020041
lipidmapsM:LMFA03020041
AHHXLFNPCWCNQF-SOOJVSLFSA-N
10,11-dihydro-12-oxo-LTB4
(5R,6Z,8E,14Z)-5-hydroxy-12-oxoicosa-6,8,14-trienoic acid
FA 20:4
O2

hmdb:HMDB12498
biggM:M_CE5944
vmhM:M_CE5944
secondary/obsolete/fantasy identifier