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TG(18:1(11Z)/18:2(9Z,12Z)/18:2(9Z,12Z))

PropertiesImage
MNX_IDMNXM135938 Image of MNXM135938
referencechebi:170847
formulaC57H100O6
global charge0
mol weight881.421
InChIKeyWOPXUTZTLHAOFJ-QHANJALHSA-N
InChIInChI=1S/C57H100O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16,18-21,23,25,27-28,30,54H,4-15,17,22,24,26,29,31-53H2,1-3H3/b19-16-,21-18-,23-20-,28-25-,30-27-/t54-/m1/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C57H100O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16,18-21,23,25,27-28,30,54H,4-15,17,22,24,26,29,31-53H2,1-3H3/b19-16-,21-18-,23-20-,28-25-,30-27-/t54-/m1/s1 Image of MNXM135938
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][C:55](=[O:58])[O:61][CH2:52][C@H:54]([CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59])[O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:60]
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:170847
chebi:170847
WOPXUTZTLHAOFJ-QHANJALHSA-N
TG(18:1(11Z)/18:2(9Z,12Z)/18:2(9Z,12Z))
[(2S)-2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl] (Z)-octadec-11-enoate

SLM:000171938
slm:000171938
WOPXUTZTLHAOFJ-QHANJALHSA-N
1,2-di-(9Z,12Z-octadecadienoyl)-3-(11Z-octadecenoyl)-sn-glycerol
TG(18:2(9Z,12Z)/18:2(9Z,12Z)/18:1(11Z))
Triacylglycerol (18:2(9Z,12Z)/18:2(9Z,12Z)/18:1(11Z))
hmdb:HMDB0049393
WOPXUTZTLHAOFJ-QHANJALHSA-N
TG(18:1(11Z)/18:2(9Z,12Z)/18:2(9Z,12Z))
(2S)-1-[(11Z)-octadec-11-enoyloxy]-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
1-(11Z-Octadecenoyl)-2-(9Z,12Z-octadecadienoyl)-3-(9Z,12Z-octadecadienoyl)-glycerol
1-Vaccenoyl-2-linoleoyl-3-linoleoyl-glycerol
TAG(18:1/18:2/18:2)
TAG(54:5)
TG(18:1/18:2/18:2)
TG(54:5)
Tracylglycerol(18:1/18:2/18:2)
Tracylglycerol(54:5)
Triacylglycerol
Triglyceride

hmdb:HMDB49393
secondary/obsolete/fantasy identifier