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20-hydroxy-leukotriene E4

PropertiesImage
MNX_IDMNXM735154 Image of MNXM735154
referencechebi:58584
formulaC23H36NO6S
global charge-1
mol weight454.609
InChIKeyBJRMBXPQAMDCMG-CMJQBAFXSA-M
InChIInChI=1S/C23H37NO6S/c24-19(23(29)30)18-31-21(20(26)14-13-16-22(27)28)15-11-9-7-5-3-1-2-4-6-8-10-12-17-25/h2-5,7,9,11,15,19-21,25-26H,1,6,8,10,12-14,16-18,24H2,(H,27,28)(H,29,30)/p-1/b4-2-,5-3-,9-7+,15-11+/t19-,20-,21+/m0/s1
SMILES[NH3+][C@@H](CS[C@H](/C=C/C=C/C=C\C/C=C\CCCCCO)[C@@H](O)CCCC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C23H37NO6S/c24-19(23(29)30)18-31-21(20(26)14-13-16-22(27)28)15-11-9-7-5-3-1-2-4-6-8-10-12-17-25/h2-5,7,9,11,15,19-21,25-26H,1,6,8,10,12-14,16-18,24H2,(H,27,28)(H,29,30)/b4-2-,5-3-,9-7+,15-11+/t19-,20-,21+/m0/s1 Image of MNXM735154
SMILES (mnx)[CH2:1](/[CH:2]=[CH:4]\[CH2:6][CH2:8][CH2:10][CH2:12][CH2:17][OH:25])/[CH:3]=[CH:5]\[CH:7]=[CH:9]\[CH:11]=[CH:15]\[C@H:21]([C@H:20]([CH2:14][CH2:13][CH2:16][C:22](=[O:27])[OH:28])[OH:26])[S:31][CH2:18][C@@H:19]([C:23](=[O:29])[OH:30])[NH2:24]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58584
chebi:58584
BJRMBXPQAMDCMG-CMJQBAFXSA-M 		20-hydroxy-leukotriene E4
(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-ammonio-2-carboxylatoethyl]sulfanyl}-5,20-dihydroxyicosa-7,9,11,14-tetraenoate
20-hydroxy-leukotriene E4(1-)
hmdb:HMDB0012639
BJRMBXPQAMDCMG-CMJQBAFXSA-N 		20-Hydroxy-leukotriene E4
(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid
20-Hydroxy-lte4
20-OH-LTE4
20-OH-Leukotriene e4
20-hydroxy-LTE4
Omega-hydroxy-lte4
Omega-hydroxyleukotriene e4
omega-hydroxy-lte4
omega-hydroxyleukotriene e4

kegg.compound:C03577
keggC:C03577
BJRMBXPQAMDCMG-CMJQBAFXSA-N 		20-Hydroxyleukotriene E4
20-OH-LTE4
20-OH-Leukotriene E4

seed.compound:cpd02247
seedM:cpd02247
BJRMBXPQAMDCMG-CMJQBAFXSA-M 		20-OH-LTE4
(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-ammonio-2-carboxylatoethyl]sulfanyl}-5,20-dihydroxyicosa-7,9,11,14-tetraenoate
20-Hydroxyleukotriene E4
20-OH-Leukotriene E4
20-hydroxy-leukotriene-E4

lipidmaps:LMFA03020025
lipidmapsM:LMFA03020025
BJRMBXPQAMDCMG-CMJQBAFXSA-N 		20-hydroxy-LTE4
20-hydroxy-Leukotriene E4
5S,20-dihydroxy-6R-(S-cysteinyl),7E,9E,11Z,14Z-eicosatetraenoic acid

bigg.metabolite:C03577
biggM:C03577
BJRMBXPQAMDCMG-CMJQBAFXSA-N 		20-hydroxy-leukotriene E4(1-)

vmhM:C03577
vmhmetabolite:C03577
BJRMBXPQAMDCMG-CMJQBAFXSA-M 		20-hydroxy-leukotriene E4(1-)
(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid

CHEBI:28700
chebi:28700
BJRMBXPQAMDCMG-CMJQBAFXSA-N 		20-hydroxy-leukotriene E4
(5S,6R,7E,9E,11Z,14Z)-6-(cystein-S-yl)-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid
20-Hydroxy-leukotriene E4
20-OH-LTE4
20-OH-Leukotriene E4
S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]-15-hydroxypentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine

metacyc.compound:20-HYDROXY-LEUKOTRIENE-E4
metacycM:20-HYDROXY-LEUKOTRIENE-E4
BJRMBXPQAMDCMG-CMJQBAFXSA-M 		20-hydroxy-leukotriene E4
(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-ammonio-2-carboxylatoethyl]sulfanyl}-5,20-dihydroxyicosa-7,9,11,14-tetraenoate

hmdb:HMDB12639
chebi:11660
chebi:1291
chebi:19798
biggM:M_C03577
keggC:M_C03577
seedM:M_cpd02247
vmhM:M_C03577 		secondary/obsolete/fantasy identifier