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6,7-dihydro-12-epi-LTB4

PropertiesImage
MNX_IDMNXM38446 Image of MNXM38446
referencechebi:187440
formulaC20H34O4
global charge0
mol weight338.488
InChIKeyZMZNVSWCIRFLBV-GRXSAWGRSA-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/h6-10,14,18-19,21-22H,2-5,11-13,15-17H2,1H3,(H,23,24)/b8-7+,9-6-,14-10+/t18-,19+/m1/s1
SMILESCCCCC/C=C\C[C@@H](O)/C=C/C=C/CC[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/h6-10,14,18-19,21-22H,2-5,11-13,15-17H2,1H3,(H,23,24)/b8-7+,9-6-,14-10+/t18-,19+/m1/s1 Image of MNXM38446
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@@H:19]([CH2:16][CH2:12][CH2:17][C:20](=[O:23])[OH:24])[OH:22])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 11
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:187440
chebi:187440
vmhM:CE5350
vmhmetabolite:CE5350
ZMZNVSWCIRFLBV-GRXSAWGRSA-M
ZMZNVSWCIRFLBV-GRXSAWGRSA-N 		6,7-dihydro-12-epi-LTB4
(5R,8E,10E,12R,14Z)-5,12-dihydroxyicosa-8,10,14-trienoic acid

bigg.metabolite:CE4988
biggM:CE4988
ZMZNVSWCIRFLBV-GRXSAWGRSA-N 		10,11-dihydro-12-epi-leukotriene B4
hmdb:HMDB0012838
ZMZNVSWCIRFLBV-GRXSAWGRSA-N 		6,7-dihydro-12-epi-LTB4
(5R,8E,10E,12R,14Z)-5,12-dihydroxyicosa-8,10,14-trienoic acid
(5S,12S)-Dihydroxy-(8E,10E,14Z)-eicosatrienoate
(5S,12S)-Dihydroxy-(8E,10E,14Z)-eicosatrienoic acid
5S12SECtr
6,7-dihydro-12-Epi-leukotriene b(,4)

lipidmaps:LMFA03020070
lipidmapsM:LMFA03020070
ZMZNVSWCIRFLBV-GRXSAWGRSA-N 		6,7-dihydro-12-epi-LTB4
(5R,8E,10E,12R,14Z)-5,12-dihydroxyicosa-8,10,14-trienoic acid
FA 20:3
O2

hmdb:HMDB12838
biggM:M_CE4988
vmhM:M_CE5350 		secondary/obsolete/fantasy identifier